(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
2
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
3
|
Cc1cs/c(=NC)/n1NC(=O)Nc2ccc(cc2)Cl
|
|
4
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
5
|
CCOC(=O)C1=C(CN(C1)Cc2ccccc2)c3ccccc3
|
|
6
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
7
|
CN(C)c1ccc(cc1)/C=C/C2=NC(=O)N[C@@H](C2)C(F)(F)F
|
|
8
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
9
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
10
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
11
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
12
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
13
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
14
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
15
|
CSc1cc(nn1C(=O)Cc2ccccc2)c3ccc(cc3)F
|
|
16
|
Cc1cc(nc2c1c3c(s2)c(n[nH]3)c4ccccc4)C
|
|
17
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
18
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
19
|
CCNc2ccccc2S/C1=Cc3nc4ccccc4s3
|
|
20
|
C=Cc1c(c(c2n1cccc2)c3c4ccccc4c(=O)[nH]n3)N
|
|
21
|
CCCCC#C/C=C/COC(=O)C
|
|
22
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
23
|
CCN1CC(=O)N=C1NCCc2cccc(c2)Cl
|
|
24
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
25
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
26
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
27
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
28
|
c1cc(ccc1C(F)(F)F)Nc2c3ccncc3on2
|
|
29
|
CC(C)Oc1cccc(c1)C(=O)Oc2nnnn2C
|
|
30
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
31
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
32
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
33
|
C1CCC(CC1)COC(=O)N2C[C@@H]3CC[C@H]2CC(=O)O3
|
|
34
|
COC(=O)[C@@H](Cc1cncn1Cc2cc(cc(c2)Cl)Cl)N
|
|
35
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
36
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
37
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
38
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
39
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
40
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
41
|
c1ccc(cc1)c2c([nH]nc2c3[nH]c4ccccc4n3)c5ccco5
|
|
42
|
CC#CC(=O)COC/C(=C/C=C)/C
|
|
43
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
44
|
Cc1cc-2n(n1)[C@@H](Nc3c2cccc3)c4cccnc4
|
|
45
|
CC1CC(N(C(=O)C1C#N)N/C=C/2C=NC3C2CCCC3)C
|
|
46
|
CC1C(N(C(C1C#C)C)C)/C=C/C(=C/C(=O)OC)/C
|
|
47
|
Cc1c(sc(=O)n1NC(=O)Cc2ccccc2)c3ccccc3
|
|
48
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
49
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
50
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
51
|
c1ccc2c(c1)ccn2Cc3nnc(s3)Cc4cccs4
|
|
52
|
CC1(COC(=N1)CCCOc2ccc(cc2Cl)Cl)C
|
|
53
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
54
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
55
|
c1ccc(cc1)c2ccc(oc2=O)C(=O)c3ccccc3
|
|
56
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
57
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
58
|
C#CCCCNc1c(=O)n(cc(n1)Cl)c2ccccc2
|
|
59
|
CC#CCCCCCCC#CC
|
|
60
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
61
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
62
|
CC1=NN(C(=O)C1)CCc2cccc(c2OC)OC
|
|
63
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
64
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
65
|
CC#CC1CCC(S1)C#CC#CC=C
|
|
66
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
67
|
CCCN(CCC)CC#CC1=CC=CCC1
|
|
68
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
69
|
|
|
70
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
71
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
72
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
73
|
CCC1=C([C@@H](C(=O)N=C1C)C=C)Oc2cc(cc(c2)C)C
|
|
74
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
75
|
C=Cn1ccnc1CCOC(=O)c2ccc(cc2)Cl
|
|
76
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
77
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
78
|
|
|
79
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
80
|
Cc1c(c2c(c(c1O)C)C[C@@H](O2)CCn3ccc(=O)c(c3C)O)C
|
|
81
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
82
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
83
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
84
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
85
|
c1ccc2c(c1)C[C@@H]3C(=O)N=C(N3C2)Nc4ccccc4F
|
|
86
|
CC(=CCC/C(=C/Cn1ccnc1)/C)C
|
|
87
|
COc1ccccc1c2ncc(s2)c3nnc4n3cccc4
|
|
88
|
CCC(CC)Nc1c(nc(c(n1)C)Oc2cc(ccn2)C)C
|
|
89
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
90
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
91
|
Cc1cc(n(n1)CSc2ccccc2)C
|
|
92
|
c1ccc(cc1)n2cccc2c3nc(nc(n3)Cl)Cl
|
|
93
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
94
|
CC(=O)OC[C@@H]1[C@H](C=C[C@@H](O1)SC2CCCCN2)OC(=O)C
|
|
95
|
CC(C)(C)OC(=O)N[C@@H](CC#Cc1ccccc1)C(=O)OC
|
|
96
|
CC(C)/C=C/C1=CC2=C(C1)Cc3c2cccc3
|
|
97
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
98
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
99
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
100
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
101
|
c1ccc(cc1)[C@@](CC#CN2CCCCC2)(C3CCCC3)O
|
|
102
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
103
|
CC(=C/C=C/c1c(c2ccccc2s1)OC(=O)N(C)C)C
|
|
104
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
105
|
c1ccc(cc1)S[C@@H]2CCc3c2cccc3
|
|
106
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
107
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
108
|
Cc1cccc(n1)C#CCSc2ccccc2
|
|
109
|
C[C@@H]1[C@@H]2[C@@H](C=C3CCCC[C@H]3[C@@H]2/C=C/c4ccccn4)C(=O)O1
|
|
110
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
111
|
CC(=CC[C@@H]1[C@@H](CCC1=O)c2cc(on2)Cc3ccccc3)C
|
|
112
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
113
|
Cc1nc(n(n1)CCNC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
114
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
115
|
c1ccc2c(c1)nc(o2)C3=CNc4ccccc4N=C3
|
|
116
|
c1ccc(cc1)/C=C/CN2CCC(CC2)C#N
|
|
117
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
118
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
119
|
Cc1ccc(n1c2[n-]c(nn2)SCCCC(=O)[O-])C
|
|
120
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
121
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
122
|
Cc1c(n2c(c1C(=O)NCc3ccccc3)NC(=O)CC2)C
|
|
123
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
124
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
125
|
CC1=Cc2c(c(c(c(c2C#N)N)C(=O)OC)C(=O)OC)C1
|
|
126
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
127
|
CCC(=O)N/C=C/c1ccccc1
|
|
128
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
129
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
130
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
131
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
132
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
133
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|
|
134
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
135
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
136
|
Cc1cc(n(n1)CCc2nnc(n2C)SC)C
|
|
137
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
138
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
139
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
140
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
141
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
142
|
[H]/N=c/n(nc(s1)c2cccs2)CC(=O)c3cccs3
|
|
143
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
144
|
|
|
145
|
C[C@@]12C=CC=C[C@@H]1NC(=C3C(=O)c4ccccc4C3=O)C=C2
|
|
146
|
c1ccc2c(c1)NS(=O)(=O)N2
|
|
147
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
148
|
CN(C)CC#Cc1cc(cnc1)C#N
|
|
149
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
150
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
151
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
152
|
CCOC(=O)CNC1=c2ccccc2=[S@@](=O)(N=N1)O
|
|
153
|
C=CCSc1nccn1c2ccccc2
|
|
154
|
|
|
155
|
C/C(=C/Oc1ccccc1)/C=C/OC
|
|
156
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
157
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
158
|
C1CCC2C(C1)[C@@H]3C4CCNCC4[C@H]2O3
|
|
159
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
160
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
161
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
162
|
CC1(C=CN(C=C1)C(=O)Nc2ccccc2)C
|
|
163
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
164
|
|
|
165
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
166
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
167
|
Cc1ccc(cc1OS(=O)(=O)c2c([nH]c(=O)s2)C)C(C)C
|
|
168
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
169
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
170
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
171
|
Cc1cc(=O)cc(o1)/C=C/c2ccnn2C
|
|
172
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
173
|
|
|
174
|
Cc1ccc(cc1)/N=C/c3cccc(c3NC2=O)C
|
|
175
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
176
|
CCc1nc(cn1/C(=C/C(=O)n2cc(nc2CC)C)/[O-])C
|
|
177
|
c1cc(oc1)c2nc3c(cc(cn3n2)C(=O)N4CCCC4)N
|
|
178
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
179
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
180
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
181
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
182
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
183
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
184
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
185
|
Cc1c(n[nH]c(=O)c1C#N)/C=C/c2cccs2
|
|
186
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
187
|
c1ccc(cc1)/C=C/c2cc(cc(=O)o2)[O-]
|
|
188
|
Cn1c(cc(n1)C(=O)OC)OC(=O)c2ccco2
|
|
189
|
c1ccc(cc1)n2c(cnn2)Cn3cnc4ccccc4c3=O
|
|
190
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
191
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
192
|
Cc1[nH]c(=O)cc(n1)CSc2ccccc2
|
|
193
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
194
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
195
|
c1cc(oc1)C(=O)c2cn(nn2)c3ccc(c(c3)Cl)Cl
|
|
196
|
CCn1c(ccn1)[C@@H]2CCCN2C(=O)NCC(=O)OC
|
|
197
|
COc1ccccc1C/C=C/c2cccs2
|
|
198
|
CCOc1ccc2c(c1)cc(c3n2c(=O)n(n3)C)C4OCCO4
|
|
199
|
|
|
200
|
CCOc1c(o/c(=NC(=O)c2ccccc2)/s1)C(=O)OCC
|
|
201
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
202
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
203
|
c1ccnc(c1)c2cn(cn2)c3cccc(c3)C#N
|
|
204
|
C1CCC(CC1)CC[C@@]2(CC(OC2)(C(F)(F)F)C(F)(F)F)O
|
|
205
|
c1ccc(cc1)c2cn3c(=O)c4ccccc4sc3c2C#N
|
|
206
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
207
|
|
|
208
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
209
|
C1CCC-2C(C1)-C3CCCC4C3C2CC(N4)CL
|
|
210
|
c1ccc(cc1)c2cn(c(cc2=O)C(F)(F)F)CC(=O)[O-]
|
|
211
|
Cn1cc(cn1)c2cc3cc(ccc3nc2)C4=NCCC4
|
|
212
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
213
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
214
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
215
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
216
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
217
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
218
|
CN(C)C1N/C(=[NH+]/CC2CCCO2)/SS1
|
|
219
|
Cc1cnc(o1)CSc2ccccc2
|
|
220
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
221
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
222
|
COC(=O)[C@@H](Cc1ccccc1)NC(=O)n2ccccc2=O
|
|
223
|
Cc1cc(n(n1)C(=O)c2c(nc(s2)Nc3ccccc3)C)C
|
|
224
|
[H]/N=c/n(cc(o1)c2ccc(cc2)CC)c3nc(cc(n3)C)C
|
|
225
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
226
|
CCCC[C@@H](CC)C(=O)N1CCN=C1C
|
|
227
|
CC/C(=C/C1CSC2C1CCCC2)/C3CCNCC3
|
|
228
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
229
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
230
|
Cc1[nH]c2cc(ccc2n1)F
|
|
231
|
Cc1ccc(cc1)S/C=C/c3ccccc3C(=O)N2
|
|
232
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
233
|
|
|
234
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
235
|
Cc1c(cn(n1)CC=C)CNCc2c(nns2)C
|
|
236
|
c1ccc2c(c1)Oc3cc4cc[nH]c4cc3S2
|
|
237
|
C1CCC(CC1)C2CCNS2
|
|
238
|
Cc1c(c(on1)C)C(=O)n2cc3c(n2)-c4cc(ccc4SC3)F
|
|
239
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
240
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
241
|
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)F)F)OC(=O)C)OC(=O)C
|
|
242
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
243
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
244
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
245
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
246
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
247
|
C1C2=C[C@@H]3C=C[C@H]2[C@@H](C=C3)NC1=O
|
|
248
|
c1ccc(cc1)NC2=NN/C(=Nc3ccccc3)/[C@H]2Cl
|
|
249
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
250
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
251
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
252
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
253
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
254
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
255
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
256
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
257
|
C1CCC(CC1)C[C@@H]2C(=O)OCC(=N2)C3CCCS3
|
|
258
|
[H]/N=c/c(c(n(s1)CC=C)N)C#N
|
|
259
|
CCCc1c(c(n(n1)C)[O-])C(=O)c2cc3ccccc3s2
|
|
260
|
CC1=Nc2ccccc2NC(C1)(C)C
|
|
261
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
262
|
CCCC(=O)[C@@H](CC)Sc1ccoc1C
|
|
263
|
CC1(C/C(=C/2C=Nc3c2cccc3)/C=C4[C@@]1(c5ccccc5N4)O)C
|
|
264
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
265
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
266
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
267
|
C[C@H]1[C@@H]([C@H](C=CO1)O)OCc2ccccc2
|
|
268
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
269
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
270
|
c1ccnc(c1)c2ccc(s2)NC(=O)N3CCOCC3
|
|
271
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
272
|
Cc1cn2c3c1CCCCn3c(n2)CN4CCCc5c4cccc5
|
|
273
|
c1ccc(cc1)c2cncs2
|
|
274
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
275
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
276
|
c1ccc(cc1)c2cc(c(o2)c3ccccc3)c4[nH]ccn4
|
|
277
|
|
|
278
|
CC1(OC(=O)C(C(=O)O1)CN/C=C/C2=CCCCC2)C
|
|
279
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
280
|
CCN(CC)c1ccc2cc3c([o+]c2c1)CCCCC3
|
|
281
|
CCOC(=O)c1c(n(c(=O)s1)c2ccccc2)N
|
|
282
|
Cn1ccc(n1)C#CCN2CCOCC2
|
|
283
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
284
|
CC1CCC(CC1)N2C=C(CC2=O)C3CCCCC3
|
|
285
|
c1ccc2c(c1)nnn2CN3CSc4c3cccc4
|
|
286
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
287
|
CC(=O)N1CN(Cn2c1nc3c2cccc3)CCc4ccccc4
|
|
288
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
289
|
c1cc(ccc1C2=C/C(=C/3C=C(C=CC3=O)Cl)/ON2)F
|
|
290
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
291
|
c1ccc(cc1)NCCn2cccc2
|
|
292
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
293
|
CCc1cccc2c1[nH]cc2C=C3C(=O)N(C(=O)N(C3=O)C)C
|
|
294
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
295
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
296
|
Cc1c(cco1)/C=C/C=C(C)C
|
|
297
|
CCOC(=O)N1CCC(CC1)c2c(c(n[nH]2)O)C
|
|
298
|
CCOC(=O)c1c(c(ccc1N(C)C)[C@@H]2C=CNC(=O)N2)C
|
|
299
|
CC1=CC[C@@H]2C[C@@H]3C(=N[C@@H]2O1)CC(CC3=O)(C)C
|
|
300
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
301
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
302
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
303
|
CCn1c2ccccc2nc1c3cnn(n3)c4ccccc4
|
|
304
|
Cc1nccc(n1)Sc2ccccc2
|
|
305
|
Cc1cccc(c1)NC(=O)N2C[C@@H]3C[C@H]2C=C3
|
|
306
|
c1cc(oc1)c2cc(sc2)Nc3ccc(cc3)S(=O)(=O)N
|
|
307
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
308
|
CN1CCc2c(c(nc3c2c(n[nH]3)N)Nc4ccc(cc4)OC)C1
|
|
309
|
CC(C)[C@@H]1NC(=O)C2CCCCC2S1
|
|
310
|
c1ccc(cc1)Nc2nc(nc3n2ncc3C#N)Nc4cccnc4
|
|
311
|
c1ccc(cc1)C(=O)/N=c/n3c(ns2)-c4ccccc4C3
|
|
312
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
313
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
314
|
c1ccc(cc1)n2c(nnn2)Sc3nc4ccccc4o3
|
|
315
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
316
|
Cc1ccc(cc1)[C@@H](C/C=C
2c(cc(n2)C)C)O
|
|
317
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
318
|
CC1CC([NH]/C(=NC(=O)CC2C(CCCC2CL)F)/C1)C
|
|
319
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
320
|
COc1cccc(c1)C2=CCN(C(=O)N2)c3ccccc3O
|
|
321
|
Cc1cnc(c(c1OC)C)C[C@@H]2Nc3ccccc3S2
|
|
322
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
323
|
|
|
324
|
c1ccc(cc1)[C@H]2[C@@H]3CCCO[C@@H]3NC(=O)N2
|
|
325
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
326
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
327
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
328
|
c1cc(c(cc1Cl)c2cc([nH]n2)C(F)(F)F)O
|
|
329
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
330
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
331
|
CCCNC(=O)NC1=NC(=C([C@H]1C)C(=O)OCC)C
|
|
332
|
Cc1cc2c(o1)cc(nc2Nc3cccc(c3)Cl)C(=O)OC
|
|
333
|
Cc1ccc(cc1)C#Cc2ccco2
|
|
334
|
c1ccc(cc1)c2cc(=O)on2S(=O)(=O)c3ccccc3
|
|
335
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
336
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
337
|
|
|
338
|
CC1(C[C@@H](c2n1ccc2)Nc3ccc(cc3)OC)C
|
|
339
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
340
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
341
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
342
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
343
|
COc1ccc(cc1)/C=C/c2nc3c(o2)C=CCC3
|
|
344
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
345
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
346
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
347
|
CCCCN1[C@@H](c2ccccc2C1=O)Sc3ccc(cc3)F
|
|
348
|
c1ccc(cc1)n2cc(cn2)c3c4cc(ccc4on3)F
|
|
349
|
c1ccn(c1)c2c(c3c(s2)CN(CC3)c4cccc(n4)F)C#N
|
|
350
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
351
|
|
|
352
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
353
|
Cc1ccccc1SCCN2CCOC2=O
|
|
354
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
355
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
356
|
CCOC(=O)CCc1c2c([nH]c1C(=O)OCC)CNC(=O)C2
|
|
357
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
358
|
CC(=O)Nc1c(c(cs1)C2=C[C@@H]3[C@@H](C=C2)OCO3)C#N
|
|
359
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
360
|
Cc1ccc(cc1)SCCN(C)Cc2cnc(nc2)OC
|
|
361
|
CCCN(C)c1ccc2c3c(cn2n1)c(nn(c3=O)C)Cl
|
|
362
|
CC(=O)N[C@@H]1Cc2c1cccc2
|
|
363
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
364
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
365
|
COc1ccc(cc1)c2cc-3n(n2)C(=O)c4c3cccc4
|
|
366
|
CC(=O)c1csc(n1)c2ccno2
|
|
367
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
368
|
c1ccnc(c1)/C=C/c2ccco2
|
|
369
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
370
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
371
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
372
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
373
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
374
|
c1cc(ccc1c2c(c3cc(c(nc3o2)Cl)C#N)N)F
|
|
375
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
376
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
377
|
c1ccc2c(c1)c(=O)[nH]c3n2nnc3
|
|
378
|
CC(=O)c1c(c(c(s1)SC)C#N)c2ccco2
|
|
379
|
c1cc(oc1)c2c(ncs2)C(=O)[O-]
|
|
380
|
c1ccc(cc1)COC2=CCCCC2
|
|
381
|
CC1(C=CN(C=C1)CCC(=O)OC)C
|
|
382
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
383
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
384
|
C=CCNC(=O)Cn1c(cc2c1nccc2)[C@@H]3CCCO3
|
|
385
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
386
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
387
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
388
|
Cc1cc(=O)[nH]c(n1)C2CC2
|
|
389
|
c1ccc(cc1)SC2=C(CC2)Sc3ccccc3
|
|
390
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
391
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
392
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
393
|
C=CCSc1cc(cc(c1C#N)c2ccccc2)C3CC3
|
|
394
|
COC(=O)c1c2n(cn1)C[C@@H](OC2=O)COc3ccccc3
|
|
395
|
CC(C)NC(=O)CSc1nnns1
|
|
396
|
Cc1cc(ccc1F)C2=C[C@H]3C(=N2)CC(CC3=O)(C)C
|
|
397
|
Cn1c2ccccc2nc1Cn3nc(nn3)c4ccccc4
|
|
398
|
CCOC(CC#CC(=O)N(C)C)OCC
|
|
399
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
400
|
Cc1c(nc2ccccc2n1)OCc3nc(no3)C4CC4
|
|
401
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
402
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
403
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
404
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
405
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
406
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
407
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
408
|
|
|
409
|
Cc1nnc(s1)SCC2=NN(C(=O)C2)c3ccccc3
|
|
410
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
411
|
C1=CC23[C@@H]1c4c(c(c(c(c4F)F)F)F)[C@@H]2C=C3
|
|
412
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
413
|
CC1NC2C(CN(N2)CC3CCCCC3)C(=O)O1
|
|
414
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
415
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
416
|
c1ccc2c(c1)cc([nH]2)c3nn4cnnc4s3
|
|
417
|
COc1ccc(cc1)c2csc3c2-n4cccc4C3=O
|
|
418
|
CN(C)C(=O)NCCN1CCCCCc2c1cccc2
|
|
419
|
CCSc1nnc(s1)/N=C(/C2CCC2)[O-]
|
|
420
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
421
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
422
|
C[C@H]1OC[C@@H]([C@@H](O1)/C=C/C(=C/C(=O)OC)/C)O
|
|
423
|
Cc1ccccc1n2n(o2)c3ccccc3C
|
|
424
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
425
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4s3
|
|
426
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
427
|
Cc1[nH]cc(n1)c2ccccc2
|
|
428
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
429
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
430
|
Cc1cc(c(=O)n(c1)Cc2cccc(c2)F)NS(=O)(=O)C
|
|
431
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
432
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
433
|
Cn1c(=O)c2c(c(n[nH]2)c3ccccc3)[nH]c1=O
|
|
434
|
Cc1ccc2c(c1)-c3cc(nn3[C@H](N2)c4ccccc4)C
|
|
435
|
CC(C)([C@@H](Cc1ccc2c(c1O)COC2)O)O
|
|
436
|
c1cc(ccc1C#N)C2=C[C@@H]3C=CSC3=N2
|
|
437
|
CCO[C@@H]1C=C/C(=C/C#Cc2ccccc2)/O1
|
|
438
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
439
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
440
|
CC(=O)c1ccc-2c(c1)-c3c2cccc3
|
|
441
|
CC1(Cc2ccccc2-c3n1c4c(c3)nc5ccccc5n4)C
|
|
442
|
COCCSc1nnc(o1)c2c[nH]c3c2cccc3
|
|
443
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
444
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
445
|
CC#CC#C/C=C/1C=C[C@@]2(O1)CC=CO2
|
|
446
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
447
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
448
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
449
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
450
|
c1ccc(cc1)c2cn3c(n2)SCC(=O)N3
|
|
451
|
Cc1cccc(n1)C#Cc2cccc(c2)c3ccco3
|
|
452
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
453
|
C=Cn1cccc1c2ccco2
|
|
454
|
CC1=CC(=O)O[C@@H](C1)c2ccccc2
|
|
455
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
456
|
C[C@@]12CCc3ccccc3[C@@]1(OC(=O)O2)C
|
|
457
|
C[C@@]12C[C@@H](c3ccccc3O1)Sc4ccccc4N2
|
|
458
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
459
|
CC(=O)NCCc1coc2c1ccnc2
|
|
460
|
c1cc2c3ccnn3nnc2cc1Cl
|
|
461
|
c1ccc(cc1)C2=COc3ccccc3O[C@@H]2C(=O)c4ccccc4
|
|
462
|
C[C@@H]1CCc2c(c(on2)[C@@H]3CCCN(C3)C(=O)c4ccco4)C1
|
|
463
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
464
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
465
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
466
|
CC(C)(C)c1cc(c(s1)C(=O)OC)CSc2ccccn2
|
|
467
|
COC(=O)[C@@]12CC3CCCCC3[C@@H]([C@@H]1C4C2CCCC4)O
|
|
468
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
469
|
CCOc1cc(c(o1)C)c2ccccc2
|
|
470
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
471
|
c1ccc(cc1)NC(=O)N/C=C/c2cccs2
|
|
472
|
Cn1cc(cn1)c2ccncc2
|
|
473
|
c1cc(sc1)c2c(n[n-]n2)C#N
|
|
474
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
475
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
476
|
CC1(c2ccccc2C(=[O+]1)c3ccc(cc3)OC)C
|
|
477
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
478
|
c1ccc(cc1)C2=CC(=O)O[C@@]23CCCC=C3
|
|
479
|
|
|
480
|
CCCC(=O)/[NH+]=c/cc(c-2c(oc3ccccc3c2n1)O)C
|
|
481
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
482
|
CCOC(=O)[C@@H]1[C@@H](N=C(N=C1C)O)/C=C/c2ccccc2
|
|
483
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
484
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
485
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
486
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
487
|
CCCCn1c(nnn1)Cn2cnc(n2)C#N
|
|
488
|
c1ccc(cc1)c2cn-3c([nH+]2)CCc4c3c5c(cccn5)cc4
|
|
489
|
CCN(CC)CC#CC1=CCCC1
|
|
490
|
CN1C=CC=C2C1=C(Cn3c2nnc3c4ccccc4)C(=O)OC
|
|
491
|
c1cc(ccc1OC=CNN/C2=C/3C=CC(=O)C=C3[O-])F
|
|
492
|
CNc1ccccc1[C@@H]2C=CC(=C2)c3ccccc3
|
|
493
|
CCOC(=O)C1=C(C[C@@H](N[C@@H]1c2ccccc2)c3ccccc3)N
|
|
494
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
495
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
496
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
497
|
CCOC(=O)c1c(c([nH]c1Br)C(=O)OCC)C
|
|
498
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
499
|
Cc1cnc(o1)COc2ccccc2
|
|
500
|
Cc1ccc(cc1)n2c(nnn2)c3cn[nH]c3c4ccccc4F
|
|
501
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
502
|
C[C@H]1[C@H]2C(=NC1=O)[N-]c3ccccc3S2
|
|
503
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
504
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
505
|
|
|
506
|
c1ccc(cc1)C2=C(C(=O)N3[C@@H]2CCC3)O
|
|
507
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
508
|
c1ccc(cc1)CNc2ncco2
|
|
509
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
510
|
c1ccc(cc1)C2=CC(=N[C@@]2(c3ccccc3)O)c4ccccc4
|
|
511
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
512
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
513
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
514
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
515
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
516
|
Cc1cc(n(n1)C)NS(=O)(=O)c2c(n(cn2)C)Cl
|
|
517
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
518
|
c1ccc2c(c1)CCN(C2)Cn3c(ncn3)c4ccccc4Cl
|
|
519
|
Cn1cc(cn1)NC(=O)c2cncn2c3ccccc3
|
|
520
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
521
|
c1cnc(nc1c2nccs2)N
|
|
522
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
523
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
524
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
525
|
Cn1ccnc1COc2ccc(cc2)N
|
|
526
|
Cc1c(sc(n1)CCn2cccc(c2=O)C(F)(F)F)C(=O)C
|
|
527
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
528
|
|
|
529
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
530
|
CCn1cc(cn1)c2ccno2
|
|
531
|
CCCCn1c(c(c2c1ncn(c2=[NH2+])c3nccs3)C)C
|
|
532
|
c1ccc(cc1)C(=O)NCn2cccnc2=O
|
|
533
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
534
|
COC(=O)CCCC1CCC(=O)N2C1NCCC2
|
|
535
|
c1ccc2cc(ccc2c1)n3c(nnn3)c4c[nH]c5c4cccc5
|
|
536
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
537
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
538
|
CCOC(=O)N1CCC(=CC1)c2c(nn(c2N)C)C
|
|
539
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
540
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
541
|
Cc1nc(nc(=O)n1c2ccccc2)Nc3ccccc3
|
|
542
|
c1ccc(cc1)C[C@@H]2C3=C(CC=CC3)C(=O)N2Cc4ccccc4
|
|
543
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
544
|
Cc1ccc(c(c1)c2cc(n[nH]2)C(=O)Nc3nnc(s3)C)O
|
|
545
|
c1ccc2c(c1)N3CN(CN=C3N2CO)Cc4ccc(cc4)Cl
|
|
546
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
547
|
CCN(CC)CC#CC(=C)C
|
|
548
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
549
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
550
|
CCOC(=O)/C=C/1CC(=O)Nc2c(non2)N1
|
|
551
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
552
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
553
|
CCNC(=O)n1cc(c(n1)c2ccccc2)c3ccncn3
|
|
554
|
|
|
555
|
c1cc(oc1)C(=O)/C=C/2C(=O)NCCN2
|
|
556
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
557
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
558
|
Cc1c(c(no1)/C=C/c2ccc(cc2)F)N
|
|
559
|
c1ccc-2c(c1)CCc3c2nnn3c4ccc(cc4)Br
|
|
560
|
CSc1nnc(c(=O)n1N)/C=C/c2cccs2
|
|
561
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
562
|
CCCCN1[C@@H](C(=C(C1=O)C)C)Sc2ccc(cc2)OC
|
|
563
|
|
|
564
|
CC1(COC(=N1)/C=C/c2ccccc2)C
|
|
565
|
CC1=NS(=O)(=O)NC2=C1CCCC2
|
|
566
|
c1ccc(cc1)[C@@H]2C(=N2)c3ccccc3
|
|
567
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
568
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
569
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
570
|
c1ccc(cc1)COc2cnc(nc2)C#N
|
|
571
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
572
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
573
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
574
|
CCOc1ccc(cc1)NC(=O)CN/C2=Nc3ccccc3F
|
|
575
|
c1ccc(cc1)[C@@H]2C3=C(c4ccccc4OC3)N=C5N2N=CN5
|
|
576
|
c1ccc2c(c1)-c3c[nH]c4c3c(ccc4)C2=O
|
|
577
|
CC1NCC2N1C=CN([C@@H]2O)C(=O)C
|
|
578
|
|
|
579
|
c1cc(cnc1)CNCCc2ccco2
|
|
580
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
581
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
582
|
c1ccc(cc1)c2cnns2
|
|
583
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
584
|
Cc1c2ccn(c(=O)c2n(n1)C)CC(=O)NC3CC3
|
|
585
|
CCc1nnc(o1)Cn2cnc3ccccc3c2=O
|
|
586
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
587
|
c1cnccc1c2cnc3c(cnn3c2)C4=CCCC4
|
|
588
|
c1cc(oc1)c2cn3c4ccc(c(c4n5c3c2CCCC5)F)F
|
|
589
|
CCCCc1cn(nn1)CC2CCN(CC2)C(=O)C
|
|
590
|
Cc1c(cco1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
591
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
|
592
|
CN1CC(=O)N=C1/N=C(/C23CC4CC(C2)CC(C4)C3)[O-]
|
|
593
|
c1ccc(cc1)NC2=Nc3ccccc3CCC2
|
|
594
|
C/C(=C/CO)/C#CCN1CCCC1
|
|
595
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
596
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
597
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
598
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
599
|
c1ccc(cc1)c2c3c(nc(s3)C#N)n(n2)c4ccccc4
|
|
600
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
601
|
c1cn[nH]c1[C@@H]2CCCN(C2)S(=O)(=O)N3CCCCCC3
|
|
602
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
603
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
604
|
CC[C@@H]1Cn2c3c(cccc3S1)cc(c2=O)c4ccccc4
|
|
605
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
606
|
COc1c2ccccc2[nH+]c3c1cco3
|
|
607
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
608
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
609
|
Cc1nc(c(n1C)O[C@@H]2CCCCO2)SCc3ccccc3
|
|
610
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
611
|
CCOc1ccc(cc1)N2C(=O)CN=C3C2=NCCC3
|
|
612
|
COC(=O)[C@@H]1CC2CNCN2C(=O)N1
|
|
613
|
Cn1c(ccn1)/C=C/c2ncc(s2)C(=O)OC
|
|
614
|
CC1=[O+]C(=C[C@@H]2[C@@H]1C=C(C(=C2)OC)OC)N3CCOCC3
|
|
615
|
c1ccc2cc3c(cc2c1)NC=C4C(=NC(=O)S4)[N-]3
|
|
616
|
c1cc(oc1)[C@@H]2Nn3c(nnc3S2)c4ccc(cc4)O
|
|
617
|
CCS(=O)(=O)Nc1ccn(n1)C
|
|
618
|
CCOC(=O)[C@@H]1[C@@H]2[C@@H](C3CCCCC3O2)C4CC(CCC4N1)CL
|
|
619
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
620
|
CC(C)(C)OC(=O)N(C)c1ccnc2c1cc[nH]2
|
|
621
|
CC(=O)OC1=CC[C@@H]2C[C@H]1C2(C)C
|
|
622
|
c1ccc(cc1)C2=C/C(=C/c4ccccc4NC3=O)/C(=O)O2
|
|
623
|
C=C1c2ccccc2C=Cc3c1cccc3
|
|
624
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
625
|
C[C@@H]1C#CC[C@@H](/C=C/CCCCC1=O)OCOC
|
|
626
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
627
|
CCOC(=O)c1ccc(cc1)n2c(=O)oc(n2)C
|
|
628
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
629
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
630
|
CC(=O)O/C=C/c1ccccc1
|
|
631
|
CC(C)(C)OC(=O)N1CCC(CC1)Oc2ccc(=O)[nH]n2
|
|
632
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
633
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
634
|
Cc1cc(n(n1)c2ccccc2)Nc3nc4ccccc4s3
|
|
635
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
636
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
637
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
638
|
COc1ccccc1Cc2c(nccn2)Cl
|
|
639
|
c1cc2c(cc1C#N)C[C@@H](O2)c3ccc(s3)Br
|
|
640
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
641
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
642
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
643
|
CNC=CN/C1=CC(=O)c2ccccc2
|
|
644
|
|
|
645
|
c1ccc(cc1)C#CC(=O)c2cccs2
|
|
646
|
c1cc(cc2c1cc[nH]2)Cl
|
|
647
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
648
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
649
|
Cc1cc(cc([o+]1)C)/C=C/c2ccccc2
|
|
650
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
651
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
652
|
Cc1c(cc2c(c(sc2n1)c3nnc(o3)C)N)C(=O)C
|
|
653
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
654
|
CCc1nnc(o1)COC(=O)cc([n-]s/c2=NC)C
|
|
655
|
c1ccc(cc1)SCn2c3ccccc3nn2
|
|
656
|
CS(=O)(=O)Nc1ccccn1
|
|
657
|
c1ccc(cc1)c2nc(on2)c3c(c4ccccc4s3)O
|
|
658
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
659
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
660
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
661
|
CC[C@@H](C(=O)N1CCC=CC1)Nc2cccc(c2)OC
|
|
662
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
663
|
CCOC(=O)c1c(cn2c1sc3ccccc3c2=O)C
|
|
664
|
c1ccc(cc1)SCc2cc(=O)c(co2)O
|
|
665
|
c1c[nH]c2c1cc3c(c2)OCO3
|
|
666
|
CCOc1c(c(=O)c1=O)/C=C/N(c3ccccc3S2)CC#C
|
|
667
|
c1ccc2c(c1)CNC(=O)CN2
|
|
668
|
c1ccc2c(c1)NCCCS2
|
|
669
|
COc1ccc(cc1)NC(=O)NC2=C(CCC2)C(=O)OC
|
|
670
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
671
|
C1CCC(CC1)[C@@H]2CC(=O)NC3C2C(OC(=O)C3C#N)N
|
|
672
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
673
|
CC1(CO[C@@]2([C@@H]1O)OC[C@@H](O2)COC3CCCCC3)C
|
|
674
|
c1ccc2c(c1)-n3cccc3C(=O)CS2
|
|
675
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
676
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
677
|
Cn1c(=O)[nH]c(=O)n2c1ncc2CC(=O)Nc3ccccc3
|
|
678
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
679
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
680
|
|
|
681
|
c1ccc2c(c1)C(=O)OS(=O)(=O)N2
|
|
682
|
c1ccc(cc1)NCc2ccco2
|
|
683
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
684
|
Cc1ccc(cc1)Sc2c(cccn2)n3cccc3
|
|
685
|
CCOC(=O)[C@@H]1[C@@H](NC(=NC1=O)C)c2ccco2
|
|
686
|
c1cc(sc1)c2ccncn2
|
|
687
|
C1CCC(CC1)NC(=O)NC2=CC=CN=CO2
|
|
688
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
689
|
CC1(C=Cc2ccccc2N1)C
|
|
690
|
COC(=O)CC/C(=C/1C(=O)CC(=N1)c2ccccc2)/[O-]
|
|
691
|
COc1c(c(=O)c2c(s1)CCCC2)N
|
|
692
|
Cc1c(non1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)O[C@@H]3CO
|
|
693
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
694
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
695
|
Cc1cc2n(c(=O)c1C#N)CC(=C2)c3ccccc3
|
|
696
|
C[C@@H]1C=C(N(C=N1)c2ccccc2)C
|
|
697
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
698
|
CSc1c(c(sn1)SC)NC(=O)OC[C@@H]2CCCO2
|
|
699
|
Cc1c(c([nH]c1C)/C=C/C(=C(C=N2)C)C)C
|
|
700
|
c1ccc(cc1)C[C@@H](C(=O)[C@@H](C#N)c2ccccn2)n3cnnn3
|
|
701
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
702
|
C[C@@]12CCC3=C([C@@H]1CCCC2=O)CSc4c3ccc(c4)OC
|
|
703
|
c1ccc(cc1)c2nc(sn2)c3ccc(nn3)Cl
|
|
704
|
c1cc(ccc1SCc2ccsc2c3ncns3)Cl
|
|
705
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
706
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
707
|
CC1(C=C(NC(=O)N1)/C=C/c2ccccc2)C
|
|
708
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
709
|
C1CCC2C(C1)CC3C(N2)-C4CCCC5C4N(C3)CCC5
|
|
710
|
|
|
711
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
712
|
CC(=O)n1c2ccccc2c3c1sc(c3C#N)N4CCCCC4
|
|
713
|
|
|
714
|
Cc1nnnn1C2CCCCC2
|
|
715
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
716
|
C1CC(C(=O)N(C1)CC2NNC(O2)C3CC3)C(F)(F)F
|
|
717
|
c1cc(sc1)c2ccno2
|
|
718
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
719
|
CCCCN/C(=CC1=NCCC1)/C
|
|
720
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
721
|
CNC(=O)N1CCOC12CCCCC2
|
|
722
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
723
|
c1cnccc1c2ccnc3n2ncc3
|
|
724
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
725
|
c1csc2c1C(=O)N[C@@H]3CCCCN3C2
|
|
726
|
COc1cc2c(cc1OC)-c3cccn3CC2
|
|
727
|
c1cc2c(cc1Cl)-c3c(c[nH]n3)CS2
|
|
728
|
[H]/N=c/n(ccs1)/N=N/c2ccccc2
|
|
729
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
730
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
731
|
|
|
732
|
Cc1c(cco1)c2nc3ccccc3s2
|
|
733
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
734
|
c1cc([nH]c1)/C=N/c2ccc(cc2)F
|
|
735
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
736
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
737
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
738
|
C=C1/C(=CNC2CCCCC2)/C(=O)N([NH]1)C3CCCCC3
|
|
739
|
c1ccc(cc1)c2c(oc(=O)o2)c3ccccc3
|
|
740
|
CC(C)(C)OC(=O)N1CC[C@@](C1)(CSc2ccncc2)O
|
|
741
|
Cc1nc(no1)CSc2ccccc2
|
|
742
|
CC(=C)c1nc(nc(n1)Oc2ccccc2)Oc3ccccc3
|
|
743
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
744
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
745
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
746
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
747
|
c1ccc(cc1)[S@](=O)CCSc2nncs2
|
|
748
|
c1ccc2c(c1)Cc3cc(sc3C=C2)Cl
|
|
749
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
750
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
751
|
Cc1nc(c(o1)Sc2ccc(cc2)Cl)C#N
|
|
752
|
COC(=O)[C@@H]1c2c(oc3cc(cc(c3c2=O)O)CO)C=C[C@@H]1O
|
|
753
|
C#CCCNc1c(=O)n(cc(n1)Cl)Cc2ccccc2
|
|
754
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4s3
|
|
755
|
c1ccc2c(c1)C=CS(=O)(=O)O2
|
|
756
|
Cc1ccc(o1)SCc2ccco2
|
|
757
|
c1ccc(cc1)n2c3=CNc4ccccc4N=c3[nH]c2=O
|
|
758
|
CC(=O)N1C[C@@H](C=C1c2ccccc2)c3ccccc3
|
|
759
|
C/C(=C/C=CC=CCc1cnco1)/[C@H](C(C)(C)C(=O)N)O
|
|
760
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
761
|
c1ccc(cc1)[C@H]2C(=O)NN=C2[O-]
|
|
762
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
763
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
764
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3cc4c(s3)CCC4
|
|
765
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
766
|
C1CCC(CC1)SC[C@@]2(CCCC=C2)O
|
|
767
|
c1ccc(cc1)CCOn2ccnc2
|
|
768
|
CCCNC(=O)CSc1c(nccn1)Sc2ccccc2
|
|
769
|
CCSc1nnc2n1CCN2c3ccccc3
|
|
770
|
c1ccc(cc1)[N-]S(=O)(=O)CC2=NC(=O)n3cccc3C2=O
|
|
771
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
772
|
|
|
773
|
c1ccc2c(c1)c(=O)oc(=O)c3n2ccc3
|
|
774
|
Cc1c(n(c(c1c2[nH]c3ccccc3n2)N)C4CCCC4)C
|
|
775
|
Cc1nc2cnccc2n1c3ccc(cc3)C4=CC(=O)NCCN4
|
|
776
|
Cc1c(c2c(o1)[C@@H]3CCCC[C@@H]3OC2=O)c4ccccc4
|
|
777
|
Cc1c(non1)OCCNC(=O)C23CC4CC(C2)CC(C4)C3
|
|
778
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
779
|
Cc1c(c(on1)C)c2nc(no2)c3ccccc3
|
|
780
|
c1ccc2c(c1)c(ns2)NCc3cccs3
|
|
781
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
782
|
c1ccc(cc1)C#CC#CC#N
|
|
783
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
784
|
CSc1nccc(n1)c2cnoc2
|
|
785
|
Cc1nn(c(=O)c2n1c3c(c2)ccs3)CCCC#N
|
|
786
|
CCC(=O)CC/C=C/C#CC#CC#CC
|
|
787
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
788
|
c1cc(oc1)c2c3c(c(c(c2C#N)N)C#N)CCCC3
|
|
789
|
Cc1csc(=O)n1CCn2nc(nn2)c3ccccc3
|
|
790
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
791
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
792
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
793
|
c1ccc(cc1)NC(=O)OCc2cncs2
|
|
794
|
CN(C)/C=C/C(=O)N=C(S1)/C=C(/c2cccs2)[O-]
|
|
795
|
Cc1ccccc1CN[C@@H]2COC[C@H]2c3ccc(cc3)F
|
|
796
|
CCOC(=O)c1c2cccc3c2n(c1c4ccccc4)CCS3
|
|
797
|
CCN(CC)C(=O)/C=C(/CCCC#N)Sc1ccccc1
|
|
798
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
799
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
800
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
801
|
c1ccc(cc1)c2c3ccccn3nc2C(=O)c4ccccc4O
|
|
802
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
803
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
804
|
CCCCN1CCc2cccc(c2SC1)C
|
|
805
|
c1ccc2c(c1)[C@@H]3c4c([nH]c(=O)s4)SC=C3CO2
|
|
806
|
CCc1c(nco1)C(=O)N2CCC(CC2)c3cc(=O)[nH]c(n3)C
|
|
807
|
C[C@@H]1c2nc3ccccc3n2CN(CO1)c4ccc(cc4)F
|
|
808
|
c1cc(oc1)OC(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
809
|
c1ccc(cc1)c2c(c(sc2SCC#N)C#N)N
|
|
810
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
811
|
Cncc([nH]/c1=NC(=O)C23CC4CC(C2)CC(C4)C3)[O-]
|
|
812
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
813
|
Cc1nc(no1)c2cccc(c2)S(=O)(=O)NCC(=O)[O-]
|
|
814
|
Cc1c(sc(c1c2ccno2)SC)C#N
|
|
815
|
Cc1c(c-2c(cn1)CCc3c2cccc3)C#N
|
|
816
|
c1ccc(cc1)[C@@H]2C3=C(c4ccccc4CC3)NC(=O)N2
|
|
817
|
|
|
818
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
819
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
820
|
c1ccc(cc1)c2cc(on2)[C@@]3(CC[C@H]4CO[C@@H]3O4)O
|
|
821
|
C(#N)c1c(c([nH]c1N)Br)C#N
|
|
822
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
823
|
c1cc(cnc1)[C@@H]2CC(=O)Nc3c2c4c(s3)CCCC4
|
|
824
|
c1ccc(cc1)/C=C/c2nnc(o2)N
|
|
825
|
CC1CC(C2C(C1)NN3C(NNC3S2)C4CCNCC4)C
|
|
826
|
C1C[C@@]2(CC(=O)OC2)CNC1=O
|
|
827
|
c1cc(ncc1C#N)NCc2nccs2
|
|
828
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
829
|
CCCCc1[nH]cc([nH+]1)CO
|
|
830
|
CCOC(=O)CC/C=C/C#C
|
|
831
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
832
|
COC(=O)c1ccc(o1)[N-]S(=O)(=O)c2ccccc2
|
|
833
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
834
|
|
|
835
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
836
|
Cn1c(cc(n1)C(=O)OC)OC(=O)C23CC4CC(C2)CC(C4)C3
|
|
837
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
838
|
CS(=O)(=O)NCc1ccccn1
|
|
839
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
840
|
|
|
841
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
842
|
c1ccc(cc1)C(=O)c2ccco2
|
|
843
|
C[C@@H]1[C@@H](OCC(=O)N1)C2CCCCC2
|
|
844
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
845
|
Cc1c(sc(n1)c2c(n(nn2)c3ccccc3)C)C(=O)[O-]
|
|
846
|
CC1CCC2C3C1[C@@H]([C@@H]([C@@H]3CCS2)C(=O)N)O
|
|
847
|
CCn1c(ccn1)C(=O)n2ccnc2C
|
|
848
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
849
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
850
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
851
|
c1ccc(cc1)c2nnc(o2)c3cc4ccccc4oc3=O
|
|
852
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
853
|
CCOC(=O)N1CCN(CC1)C2NNC3NCCN3N2
|
|
854
|
|
|
855
|
Cc1nc2c(n1C)CCN(C2)C[C@@H](c3ccc(cc3)OC)O
|
|
856
|
c1cnoc1c2ccsc2
|
|
857
|
CC(=C)[C@@H](C(=O)OC)N1C(=O)C(CS1)NCC2CCCCC2
|
|
858
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
859
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
860
|
Cc1cc(n(n1)C(=O)c2c(nns2)C)C
|
|
861
|
CCc1ccccc1C(=O)c2ccccc2
|
|
862
|
C=CCCOCOCCC=C
|
|
863
|
Cc1nnc(s1)Sc2cc(=O)oc3c2cccc3
|
|
864
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
865
|
C=CCOc1cccnc1N
|
|
866
|
CCCCSc1nc(c2nc3ccccc3c(=O)n2n1)[O-]
|
|
867
|
Cc1ccc(cc1)c2nc(c(nn2)C)Sc3ccc(cc3)F
|
|
868
|
c1cc(c(nc1)n2cccn2)N
|
|
869
|
c1cc(sc1)c2nn(c(=O)n2c3ccncc3)CCC#N
|
|
870
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
871
|
Cc1cc([nH]n1)NC(=O)c2cccc(c2)Cl
|
|
872
|
|
|
873
|
CCOC(=O)N1C=CC=C[C@@H]1CC=C
|
|
874
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
875
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
876
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
877
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
878
|
Cc1cc2c(c(nn2C)C)c(=O)n1Nc3ccccc3
|
|
879
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
880
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
881
|
c1ccc(cc1)[C@@H]2N(C(=O)C=C(O2)c3ccccc3)c4ccccc4
|
|
882
|
C1CCC(CC1)C2NOC(=O)N2CC3CN4CCSC4N3
|
|
883
|
Cc1cc2n(c(c(s2)C(=O)C)[O-])c(=[NH2+])n1
|
|
884
|
C1CCC(CC1)[C@@H]2CCC(=O)N2
|
|
885
|
CN1CCN(CC1)C2=Nc3cc(ccc3Cc4c2cccc4)F
|
|
886
|
c1cn(cn1)Cc2cnc(s2)Cl
|
|
887
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
888
|
CC(=O)c1ccc2=c3cc(ccc3=c2c1)C(=O)C
|
|
889
|
CCOC(=O)C=NN=C/C1=N/NSC2CCC(CC2)C
|
|
890
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
891
|
Cn1c(=O)[nH]c(=O)n(c1=O)c2ccc(cc2)Oc3ccc(cc3)F
|
|
892
|
c1cc2c3c(c1)NC(=O)C4=C(N3CCC2)CCC4
|
|
893
|
c1ccc(cc1)S[C@@H]2c3ccccc3C(=O)O2
|
|
894
|
CCNc1nc2c(s1)c(c(c(n2)N)C#N)c3ccccc3
|
|
895
|
CCCCc1ncc(n1C(=O)C)COC(=O)C
|
|
896
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
897
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
898
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
899
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
900
|
c1csc2c1[nH]c(=O)oc2=O
|
|
901
|
C1CC2N(C1)[C@@H](OC2=O)C3CCCO3
|
|
902
|
CC1=C(C[C@@H](C(=O)N1)C#N)c2ccc(cc2)n3ccnc3
|
|
903
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
904
|
C=Cn1cccc1c2cccs2
|
|
905
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
906
|
COc1ccc2c(n1)cc([nH]2)C=C
|
|
907
|
Cc1coc(=O)n1c2ccc(c(c2)Cl)Cl
|
|
908
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
909
|
C1CCC(CC1)C2=CC(=C(C2)C(=O)[O-])C3CCCCC3
|
|
910
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
911
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
912
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
913
|
c1ccc(cc1)SCc2cnc(s2)Cl
|
|
914
|
c1ccc(cc1)C(=O)N2CCC3=CC(=O)O[C@@H]3C2
|
|
915
|
CC1=NN=C2[C@H]1C(=c3ccccc3=[NH+]2)Oc4ccc(cc4)OC
|
|
916
|
c1ccc(cc1)c2c[nH]nc2c3ccc(cc3O)O
|
|
917
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
918
|
C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2[C@H]4CO[C@@H](C3=O)O4
|
|
919
|
c1cc(cnc1)CCNCc2cscn2
|
|
920
|
CCOC(=O)/C=C(/c1cnc2n1cccc2)C(F)(F)F
|
|
921
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
922
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
923
|
CNC(=O)C=NNS/C1=C/2C(=O)N(N=N2)c3ccccc3
|
|
924
|
Cc1nc2c(n1c3ccccc3)nc(s2)C
|
|
925
|
c1ccc(cc1)c2csc(n2)C(C#N)C#N
|
|
926
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
927
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
928
|
c1cc(oc1)c2c(sc(c2c3ccco3)C(=O)N)C#N
|
|
929
|
Cc1ccc2c(c1)C=Cc3ccccc3O2
|
|
930
|
Cn1c(ccn1)[C@@H](c2cccs2)O
|
|
931
|
C1CCC2C(C1)CC3N(C2=O)CCN3
|
|
932
|
Cc1nn(c(=O)n1N)Cc2nnc(s2)Nc3ccccc3
|
|
933
|
c1cn(nc1n2cnnn2)C34CC5CC(C3)CC(C5)C4
|
|
934
|
Cc1csc(n1)Cc2nc(no2)c3ccc(cc3)O
|
|
935
|
c1ccc(cc1)n2cc(nc2)NC(=O)n3ccccc3=O
|
|
936
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
937
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
938
|
CCCCc1ccc(cc1)On2ccc(=O)cc2
|
|
939
|
c1ccc2c(c1)cc(c(=O)o2)C3=CSC(=C4C=CC(=O)C=C4)[N-]3
|
|
940
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
941
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
942
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
943
|
CC(C)/N=c/1ccccn1C(=O)COc2ccc(cc2)Cl
|
|
944
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
945
|
C1[C@H]2[C@H]3CO[C@@H]([C@@H]1NC(=O)N2)O3
|
|
946
|
c1ccc(cc1)S(=NC(=O)c2ccco2)c3ccccc3
|
|
947
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
948
|
Cc1cccc(n1)C#CCNc2ccccc2
|
|
949
|
C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)CCNc2ccccn2
|
|
950
|
c1ccc(cc1)n2cc(cn2)CN3CCSc4c3cccc4
|
|
951
|
c1ccc2c(c1)[C@@H]3[C@H]4C3C(=O)NC2c5c4cccc5
|
|
952
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
953
|
CC(C)c1nnc(o1)c2cc3c(nn(c3s2)C)C(F)(F)F
|
|
954
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
955
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
956
|
C1CCC2(CC1)CCCN=C2
|
|
957
|
c1ccc2c(c1)Cc3c(ccs3)C=C2
|
|
958
|
c1cc([nH]c1)c2nnc(o2)SCC(F)(F)F
|
|
959
|
Cc1nc(cs1)C#Cc2ccccn2
|
|
960
|
Cc1c(nc(nn1)N)/C=C/c2cc(cc3c2cccc3)O
|
|
961
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
962
|
Cc1c(cc(o1)c2ccno2)S(=O)(=O)NC
|
|
963
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
964
|
CCCCN1[C@@H](C(=C(C1=O)C)C)Nc2ccc(cc2)C#N
|
|
965
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
966
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
967
|
CC1=C[C@@]2([C@@H](N=C1)N(C(=O)O2)C3CCCCC3)C
|
|
968
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
969
|
COC1=C(C(=O)O[C@@H]2[C@@H]1C=CC=C2)Cc3ccccc3
|
|
970
|
CCCCCC(=O)OCC#C
|
|
971
|
CC(=O)C#C/C=C/c1ccccc1
|
|
972
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccccn3)O
|
|
973
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
974
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
975
|
Cc1c(con1)c2ccccc2
|
|
976
|
Cc1ccc(cc1)n2ccnc2
|
|
977
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Nc3ccc4c(c3)OCO4
|
|
978
|
Cnccs/c1=NC(=O)Nc2ccccc2
|
|
979
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
980
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
981
|
Cc1cc(no1)CSc2ccccn2
|
|
982
|
Cc1ccc(c(c1)n2cccn2)c3c4c(nc[nH]4)ncn3
|
|
983
|
CCCC(=O)OCOC(=O)/C=C(C)/N
|
|
984
|
CC1=Nc2c(cnn2C)C(=O)CC1
|
|
985
|
Cc1c2cc(ccc2[nH]n1)F
|
|
986
|
Cc1ccc(cc1)Nc2[nH+]c(=O)cc(s2)C
|
|
987
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
988
|
c1ccc2c(c1)nnn2CCS(=O)(=O)N3CCCC3
|
|
989
|
CC(=O)OC/C=C/c1cccnc1
|
|
990
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
991
|
Cn1c(nnn1)SCc2cnc(s2)c3ccccc3
|
|
992
|
c1ccc2c(c1)C3c4ccccc4C2O3
|
|
993
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
994
|
c1ccc2c(c1)c(no2)/C=C/c3ccncc3
|
|
995
|
c1ccc(cc1)c2cc(cc(=O)o2)[O-]
|
|
996
|
C[C@@H]1Cc2c3c(cccc3N1)ncn2
|
|
997
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
998
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
999
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
1000
|
CN1[C@@H]([C@H](CC1=O)c2ccccc2)[C@H](C#Cc3ccccn3)O
|
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