(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
2
|
c1ccc(cc1)Oc2c(c3ccccc3[nH]2)c4ccco4
|
|
3
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
4
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
5
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
6
|
Cc1cc(nc(n1)SC)n2ccc(=O)[nH]c2=O
|
|
7
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
8
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
9
|
C[C@@H]1c2cccn2CCN1c3c4cn[nH]c4nc(n3)N
|
|
10
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
11
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
12
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
13
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
14
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
15
|
Cc1c2c(nc(oc2=O)c3ccccc3Cl)sn1
|
|
16
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
17
|
c1ccc(cc1)c2csc(n2)n3cccn3
|
|
18
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
19
|
Cc1cc(nc(n1)n2c(cc(=O)[nH]c2=O)N)C
|
|
20
|
c1ccc2c(c1)-c3nc4ccccc4n3[C@H](N2)c5ccco5
|
|
21
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
22
|
Cc1nc(c2c(n1)oc(n2)C)n3cc(c(=O)[nH]c3=O)F
|
|
23
|
c1cc(cc(c1)N)c2cocn2
|
|
24
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
25
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
26
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
27
|
c1cc(cc(c1)Cl)c2nnn(n2)c3ccc4nnnn4n3
|
|
28
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
29
|
Cn1c(=O)c(nn(c1=O)c2ccc(cc2F)F)c3ccn[nH]3
|
|
30
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
31
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
32
|
CC1CCC2C(C1)NC(C(=O)O2)C3CCCCC3
|
|
33
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
34
|
Cc1c(cco1)c2nc3ccccc3s2
|
|
35
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
36
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
37
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
38
|
CCc1nc2ccsc2c(n1)c3ccccn3
|
|
39
|
|
|
40
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
41
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
42
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
43
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
44
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
45
|
c1ccc(cc1)c2ccncn2
|
|
46
|
C[C@]1(c2ccccc2O[C@H]1n3c4ccccc4nn3)CO
|
|
47
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
48
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
49
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
50
|
CC1(c2c(c3ccccc3[nH]2)-c4c(ccc5c4oc(=O)cc5)O1)C
|
|
51
|
Cc1c2ccccc2nc-3c1CSc4c3cccc4F
|
|
52
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
53
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
54
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
55
|
CC1NC(CC(=O)O1)C2CCCCC2
|
|
56
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
57
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
58
|
Cc1csc(n1)c2cn(c(=O)[nH]c2=O)C
|
|
59
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
60
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
61
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
62
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
63
|
c1ccc(cc1)S(=O)(=O)Oc2ccccc2c3nnco3
|
|
64
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
65
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
66
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
67
|
c1ccc(cc1)c2cnccn2
|
|
68
|
CCCNC(=O)NC1=NC(=C([C@H]1C)C(=O)OCC)C
|
|
69
|
c1ccc2c(c1)nnn2C3=[NH+]CCN3
|
|
70
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
71
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
72
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
73
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
74
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
75
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
76
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
77
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
78
|
Cc1c(cco1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
79
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
80
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
81
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
82
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
83
|
C=CCNC(=O)Cn1c(cc2c1nccc2)[C@@H]3CCCO3
|
|
84
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
85
|
c1ccc(cc1)c2ccccn2
|
|
86
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
87
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
88
|
c1ccc2c(c1)CC[NH+]=C2c3ccco3
|
|
89
|
Cc1cc(c2nncn2n1)n3cc(c(=O)[nH]c3=O)F
|
|
90
|
Cc1cc(nc(n1)Nc2ncc(n2c3ccccc3)O)C
|
|
91
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
92
|
CC[C@@H]1Nc2ccccc2N1c3ccc(cc3)Cl
|
|
93
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
94
|
c1cc(oc1)c2c3c(c4c(n2)C=C[C@@H]5[C@@H]4C=CC=C5)CCC3
|
|
95
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
96
|
COC(=O)N1C[C@@H]2CC=C[C@@H](C2)C3C1CCCC3
|
|
97
|
|
|
98
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
99
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
100
|
CC1=C(Oc2ccccc2O1)c3ccccn3
|
|
101
|
Cn1cnn2c1nc(c2)c3ccccc3
|
|
102
|
Cc1c(=O)n2c(nn1)sc(n2)c3ccco3
|
|
103
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
104
|
COC(=O)n1c(=O)c2ccccc2c(n1)OC(=O)OC
|
|
105
|
Cc1csc(n1)N2CCc3c2cccc3
|
|
106
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
107
|
C=CCNc1nc(nc(n1)n2ccnc2)c3ccccc3
|
|
108
|
Cc1nc2c(n1c3ccccc3)nc(s2)C
|
|
109
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
110
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
111
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
112
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
113
|
c1ccc2c(c1)[nH]c(=O)c(n2)n3ccnc3
|
|
114
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
115
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
116
|
c1cc2c(nc3ccsc3n2c1)N4CCC=CC4
|
|
117
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
118
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
119
|
CCc1cccc([o+]1)c2ccccc2
|
|
120
|
|
|
121
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
122
|
c1cc(cc(c1)OCc2cscn2)N
|
|
123
|
c1ccc(cc1)c2cc3ccsc3o2
|
|
124
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
125
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
126
|
Cc1c(c(n[nH]1)n2cnc3ccccc3c2=O)c4ccccc4
|
|
127
|
CCOC(=O)C1=C(Sc2ccccc2C1)NC(=O)C
|
|
128
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
129
|
Cc1cc(n(n1)c2cccc(c2)c3cccc(n3)N)C
|
|
130
|
Cc1c(snn1)c2cc(nc(n2)SC)[O-]
|
|
131
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
132
|
|
|
133
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
134
|
COc1ccc(cc1)n2c(=O)c(c3c(n2)NC(=O)C3)C#N
|
|
135
|
CC1NNC2N1CC[NH]C2=O
|
|
136
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
137
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
138
|
Cc1ccc(n1c2c3c(cccc3F)n(n2)S(=O)(=O)C)C
|
|
139
|
CCOC(=O)CCc1c2c([nH]c1C(=O)OCC)CNC(=O)C2
|
|
140
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
141
|
c1ccc(cc1)c2cccnn2
|
|
142
|
COC(=O)c1c([nH]c(c1C(=O)OC)c2ccsc2)C#N
|
|
143
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
144
|
Cc1nc2ccccc2c3n1nc(n3)n4cnnn4
|
|
145
|
Cc1nnc2n1nc(n2c3ccccc3)[O-]
|
|
146
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
147
|
Cc1ccc(n1c2cnccn2)C
|
|
148
|
CNc1nc(nc(n1)n2c3ccccc3nc2C(F)(F)F)NC
|
|
149
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2c4ccccc4C=C3)C#N
|
|
150
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
151
|
Cc1cc(=O)n2c([nH]1)c(c(n2)NC)c3nc(no3)c4ccccc4
|
|
152
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
153
|
c1cc(cc(c1)N)C2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
154
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
155
|
CC1(Cc2ccccc2C(=[NH+]1)c3cc4ccccc4oc3=O)C
|
|
156
|
Cc1c(c(no1)c2ccccc2)c3nc4ccccc4c(=O)o3
|
|
157
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
158
|
|
|
159
|
c1ccc2c(c1)c3c([nH]2)cccc3O
|
|
160
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
161
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
162
|
c1ccc(cc1)n2c3c(cn2)C(=O)CC3
|
|
163
|
Cc1ccc(cc1)n2c(nnn2)c3csc(n3)c4ccccc4
|
|
164
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
165
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
166
|
c1ccc(cc1)c2cnc3n2nccc3
|
|
167
|
CC1CC2C(CC1C)N(C3C(C(=O)[NH]C(N3)N)C2(C)C)C
|
|
168
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
169
|
Cc1cc(nc(n1)N2C=C[C@H]3[C@@H]4C[C@H]([C@@H]2C3=O)C=C4)C
|
|
170
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
171
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
172
|
Cc1c(c(on1)C)/C=C/c2c(=O)[nH]c3ccccc3n2
|
|
173
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
174
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
175
|
Cc1ccc(o1)[C@@]2(CCNC(=O)O2)C(F)(F)F
|
|
176
|
c1ccc2c(c1)cccc2C[C@@H]3NCC=N3
|
|
177
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
178
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
179
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
180
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
181
|
Cc1csc(n1)c2nnc(o2)N
|
|
182
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
183
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
184
|
c1cc(c(nc1)n2cccn2)N
|
|
185
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
186
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
187
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
188
|
CCN1C=C([C@@H](NC1=O)c2ccccc2)c3csc(n3)C
|
|
189
|
Cc1c([o+]c(nc1c2ccccc2)c3ccccc3)/C=CN(C)C
|
|
190
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
191
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
192
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
193
|
c1cc(c(nc1)n2cncn2)N
|
|
194
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
195
|
c1ccc2c(c1)[C@@H]3C4=C(CCCC4)C(=C3NC2=O)C(=O)N
|
|
196
|
CC1(CCc2c(ccc3c2cc(o3)c4ccccn4)O1)C
|
|
197
|
CC1([C@@](c2ccccc2O1)(c3ccc4ccccc4n3)O)C
|
|
198
|
CC1C(C(=O)NC([NH]1)N)N2C(=O)C3CCCCC3NN2
|
|
199
|
c1ccc(cc1)[C@@H]2C3=C(CCCC3)[NH+]=C4N2NN=N4
|
|
200
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
201
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
202
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
203
|
|
|
204
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
205
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
206
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
207
|
c1cc(cc2c1cc[nH]2)Cl
|
|
208
|
c1ccc(cc1)n2nc3ccc4c(c3n2)non4
|
|
209
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
210
|
c1ccc(cc1)CN2C[C@@H](c3c2ncc(n3)c4ccccc4)C#N
|
|
211
|
c1ccc-2c(c1)CCc3c2nc4c(n3)c(ncn4)O
|
|
212
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
213
|
[H]/N=c/n(c2c(s1)CCCC2)CC(=O)c3ccccc3
|
|
214
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
215
|
Cc1conc1n2c(=O)nc3ccccc3n2
|
|
216
|
c1c2c(cc(c1N3CCCC3)F)nc(c(n2)N)C#N
|
|
217
|
c1cn(cn1)c2nc(nc(n2)Cl)N3CCCCC3
|
|
218
|
Cc1c(c(on1)C)c2nc(no2)c3ccccc3
|
|
219
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
220
|
c1cnccc1c2cc3n(n2)CCNC3=O
|
|
221
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
222
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
223
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
224
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
225
|
Cc1c(c2nnc3c(=O)[nH]oc3n2n1)c4ccccc4
|
|
226
|
CCOC(=O)c1c(cn2c1SCC2=O)c3ccc(cc3)F
|
|
227
|
Cc1cc(n(n1)c2nc(nc(n2)OC)n3c(cc(n3)C)C)C
|
|
228
|
Cc1csc(n1)c2c(nc3n2ccs3)C
|
|
229
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
230
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
231
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
232
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
233
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
234
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
235
|
c1ccc(cc1)c2c3ccccn3nn2
|
|
236
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
237
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
238
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
239
|
CCOC(=O)N1CCNC(=O)C1
|
|
240
|
CNc1nnc(s1)c2cnccn2
|
|
241
|
CC1=C(C(=O)NC1)c2ccccc2
|
|
242
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
243
|
c1ccc(cc1)c2nnc3n2CCCS3
|
|
244
|
c1ccc(cc1)c2c3c(on2)CCNC3
|
|
245
|
c1c[nH]c2c1c(ncc2)Cl
|
|
246
|
C=C1/C(=C/C2CCCS2)/C(=O)N([NH]1)C3CCCCC3
|
|
247
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
248
|
c1ccc(cc1)n2c3c(cn2)CNCC3
|
|
249
|
CCOC(=O)C1=C(NC(=C2[C@@H]1c3ccccc3OC2=O)C)C
|
|
250
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
251
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
252
|
CCOC(=O)N1CCC2C([NH]OC2=O)CC1
|
|
253
|
c1ccc(cc1)c2cc(c(nn2)c3ccccc3)c4ccco4
|
|
254
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
255
|
c1ccc(cc1)n2c3=CNc4ccccc4N=c3[nH]c2=O
|
|
256
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
257
|
c1ccc2c(c1)c3c([nH]2)CCC3
|
|
258
|
c1ccc(cc1)C2=NS(=O)(=O)Nc3c2cccc3
|
|
259
|
CC(C)Oc1c(c(=O)c1=O)c2ccco2
|
|
260
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
261
|
Cc1csc(=O)n1CC(=O)ncccc/c2=NC(C)C
|
|
262
|
CC1(Cc2c(cc3c4c([nH]c(=O)[nH]4)sc3n2)CO1)C
|
|
263
|
CC1CC(N(N1)C2C3CCCCC3SN2)C
|
|
264
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
265
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
266
|
CC1(Nc2ccnn2C(=N1)Oc3ccccc3)C
|
|
267
|
CNCC(=N/C1=NC(=O)Nc2ccc(cc2)O)[O-]
|
|
268
|
Cc1nn(c(=O)o1)c2cc(ccn2)C(F)(F)F
|
|
269
|
c1ccc(cc1)c2cc(c(o2)c3ccccc3)c4[nH]ccn4
|
|
270
|
c1ccc2c(c1)-c3nncn3-c4ccccc4S2
|
|
271
|
CC1(Cc2c(c3nncn3c(n2)c4ccccc4)CO1)C
|
|
272
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
273
|
COC(=O)N1CCc2c(s[nH]c2=O)C1
|
|
274
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
275
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
276
|
C/C=C/N1[C@H]2C=C[C@@H](C1=O)C(=C2C(=O)OC)C(=O)OC
|
|
277
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
278
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
279
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
280
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
281
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
282
|
Cc1ccc(o1)/C=C(C)/CO
|
|
283
|
Cc1c(nc2ccccc2n1)c3cscn3
|
|
284
|
Cc1c(cco1)c2nc3n(n2)C[C@@H]4[C@@H]3C=CC=C4
|
|
285
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
286
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
287
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
288
|
c1ccc2c(c1)c-3nc4ccc(cc4[nH]n3c2=O)N
|
|
289
|
CCc1c(c(on1)C)c2nn3c(nnc3s2)C
|
|
290
|
c1ccc(cc1)NC2=Nc3ccccc3CCC2
|
|
291
|
c1ccc(cc1)c2nnc3n2CCCC3
|
|
292
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
293
|
Cc1nc(c(c(n1)SC)C#N)n2cccc2
|
|
294
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
295
|
Cn1c2ccccc2nc1Nc3c(=O)[nH]c(=O)[nH]n3
|
|
296
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
297
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
298
|
CCOc1ccc(cc1)N2C(=O)CN=C3C2=NCCC3
|
|
299
|
c1ccc(cc1)[C@@]2(c3cnncc3C(=O)N2)O
|
|
300
|
CC1(C[C@@H]2[C@@H](C1)[C@](Cc3cocc3[C@@H]2O)(C)O)C
|
|
301
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
302
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
303
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
304
|
CC1(c2nnnn2-c3cc(ccc3C(=O)N1)C(=O)OC)C
|
|
305
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
306
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
307
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
308
|
C1CCC(CC1)NC2CCC3N(C2=O)CCC3
|
|
309
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
310
|
C1CCC2C(C1)CC3C(N2)-C4CCCC5C4N(C3)CCC5
|
|
311
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
312
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
313
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
314
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
315
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
316
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
317
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
318
|
CC1=C2C=CC=C[C@@H]2c3nc4ccc(cc4n3N1)Cl
|
|
319
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
320
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
321
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
322
|
CCCCCCC1CN[NH]N1
|
|
323
|
c1ccc(cc1)n2c3ccsc3cn2
|
|
324
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
325
|
c1cc(c(nc1)c2ccsc2)N
|
|
326
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
327
|
Cc1cc(n2c(n1)ncn2)Oc3c(cn(n3)Cc4ccco4)C
|
|
328
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
329
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
330
|
Cc1ccc(cc1)C2=Nc3ccccc3NC(=N2)c4ccncc4
|
|
331
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
332
|
c1cc2c(cc1C(F)(F)F)nc(s2)c3csnn3
|
|
333
|
Cn1cc(cn1)NC(=O)c2cncn2c3ccccc3
|
|
334
|
c1ccc2c(c1)C(=O)CCCN2
|
|
335
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
336
|
Cc1cc(c(o1)C)c2csc(n2)NC(=O)C
|
|
337
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
338
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
339
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
340
|
CC(C)Nc1nc(nc(n1)N2CC(=O)N=C2N)NC(C)C
|
|
341
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
342
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
343
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
344
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
345
|
CC[C@@H]1c2c(c3ccccc3oc2=O)Oc4c1c(=O)[nH]c(n4)C
|
|
346
|
C1CSCC1C2[NH]NC(N2)C3CCSC3
|
|
347
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
348
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
349
|
|
|
350
|
c1csc(c1Cl)c2c[nH]c(c2C#N)N
|
|
351
|
c1ccnc(c1)C2=CCCCC2
|
|
352
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
353
|
c1cc(ncc1C#N)NCc2nccs2
|
|
354
|
CC1(C(=N[C@@H](C(=O)N1)c2ccccc2)c3ccccc3)C
|
|
355
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
356
|
c1ccc(cc1)n2ncc(n2)c3[n-]nnn3
|
|
357
|
CC1([C@@H]2CCC(=C)[C@@H](C2)C(=N1)C(=O)C3C[NH]C4C3CCCC4)C
|
|
358
|
c1ccc2c(c1)-c3nc(nn3CN2)c4ccsc4
|
|
359
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
360
|
Cc1c-2c(n(n1)c3ccccn3)CCc4c2onc4
|
|
361
|
CCOC(=O)C1=C(Oc2ccccc2NC1=O)N
|
|
362
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
363
|
Cc1c2c(nc(n1)C)Oc3ccc4ccccc4c3C2
|
|
364
|
c1ccc(cc1)c2cscn2
|
|
365
|
CCCc1nc(c2n1nc([nH]c2=O)c3ccccc3OCC)C
|
|
366
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
367
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
368
|
c1ccc(cc1)[C@H]2[C@@H]3CCCO[C@@H]3NC(=O)N2
|
|
369
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
370
|
Cc1[nH]c(=O)cc(n1)CSc2ccccc2
|
|
371
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
372
|
Cc1[nH]c(=O)c2c(n1)N=C(C[C@@H]2c3ccccc3)O
|
|
373
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
374
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
375
|
CC(C)(C)c1cc2n(n1)C3=NCCN3C=N2
|
|
376
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
377
|
Cc1csc(n1)c2cn[nH]c2N
|
|
378
|
Cn1cc(ccc1=O)c2c(cccn2)Cl
|
|
379
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
380
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
381
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
382
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
383
|
CCOC(=O)C1=C(N=C(N[C@H]1c2ccccc2)O)C
|
|
384
|
|
|
385
|
CCOC(=O)N1CCC(CC1)c2c(c(n[nH]2)O)C
|
|
386
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
387
|
C1CCC2C(C1)C(N3C2SCC3)C4NC(NC(N4)F)F
|
|
388
|
c1ccc(cc1)n2cccc2c3nc(nc(n3)Cl)Cl
|
|
389
|
CSc1c-2c(cs1)CCc3c2n[nH]c3
|
|
390
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
391
|
CC(C)C1C(C2CC3C(CC2NN1)C4CCCCC4O3)N
|
|
392
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
393
|
CSc1c2c([o+]c(n1)c3ccccc3)CCCC2
|
|
394
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
395
|
c1ccc(cc1)c2c3n(cn2)CCCCC3
|
|
396
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
397
|
C/C=C/C=C/C1=CC(=O)CCN1
|
|
398
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
399
|
CCOC1(Cc2c1cc3ccccc3n2)OCC
|
|
400
|
c1cc(oc1)c2nnc(s2)N
|
|
401
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
402
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
403
|
Cc1c(sc(n1)NC(=O)C)c2nc(no2)c3ccccc3
|
|
404
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
405
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
406
|
C1Cc2c(sc3c2c(c(c(=O)[nH]3)C#N)N)C1
|
|
407
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
408
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
409
|
Cc1c(oc(n1)S[C@@H](C)c2cccnc2)C
|
|
410
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
411
|
c1csc(n1)c2nccs2
|
|
412
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
413
|
CSc1nc(cc(n1)n2cnc3c2cccc3)c4ccccc4
|
|
414
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
415
|
CSc1nc(c(nn1)c2ccco2)c3ccco3
|
|
416
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
417
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
418
|
CC1(OC(=O)C(=c2c3cccc4c3c([nH]2)ccc4)C(=O)O1)C
|
|
419
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
420
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
421
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
422
|
Cc1ccc(n1c2c(c(c(o2)C)C)C#N)C
|
|
423
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
424
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
425
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
426
|
C1CN2C(NC1=[NH2+])O[C@@H]3[C@H]2C[C@@H]([C@H]3O)CO
|
|
427
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
428
|
CC(=C/C=C/c1c(c2ccccc2s1)OC(=O)N(C)C)C
|
|
429
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
430
|
COC(=O)c1c(c(n2c1oc3c2cccc3)Cl)C(=O)OC
|
|
431
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
432
|
COC(=O)c1cc2cc(oc2[nH]1)C#N
|
|
433
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
434
|
c1cc(oc1)c2ccnc3n2ncc3
|
|
435
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
436
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
437
|
Cc1cc(on1)c2cnc(nc2CCNC(=O)C3CC3)C
|
|
438
|
c1ccc(cc1)c2nc(cc(=O)o2)[O-]
|
|
439
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
440
|
c1cc(oc1)c2cn3c(n2)sc(n3)c4ccco4
|
|
441
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
442
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
443
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
444
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
445
|
Cc1c(nnn1c2ccsc2C(=O)OC)C(=O)C
|
|
446
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
447
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
448
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
449
|
CC1=CC2=C([C@@H]([C@@H]3[C@@H]1CC(C3)(C)C)O)C(=O)O[C@@H]2O
|
|
450
|
Cc1cc(n2c(n1)nnn2)c3ccccc3
|
|
451
|
Cc1cc(n(n1)c2ccccc2)Nc3nc4ccccc4s3
|
|
452
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
453
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
454
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
455
|
c1ccc2c(c1)[nH]c(=O)n2c3csc(n3)c4ccncc4
|
|
456
|
CCc1ccc(cc1)[C@@H]2c3cc(ccc3-c4c2nc(o4)N)N
|
|
457
|
Cc1cnc(nc1c2ncnn2C)N
|
|
458
|
c1ccc2c(c1)N=C(C[C@@H](S2)c3cccs3)c4ccco4
|
|
459
|
c1ccc(cc1)c2cc(c(o2)n3cccc3)C#N
|
|
460
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
461
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
462
|
CC1=C([C@@H](OC1=O)c2ccco2)c3ccco3
|
|
463
|
c1csc(c1C#N)n2cc(c(=O)[nH]c2=O)C#N
|
|
464
|
C1CCC2C(C1)C3C([NH]2)C(=O)CCS3
|
|
465
|
CCCNC(=O)Cc1nc[nH]n1
|
|
466
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
467
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
468
|
c1cc(oc1)c2nc(on2)CO
|
|
469
|
c1cnc(nc1c2nccs2)N
|
|
470
|
|
|
471
|
Cn1c(c(c(=O)n1c2ccccc2)C3=NCCC3)N
|
|
472
|
c1ccc(cc1)C2=NC(=O)CCC2
|
|
473
|
c1ccc(cc1)C2=C3[C@@H](CCC2)C(=O)C(=O)O3
|
|
474
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
475
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
476
|
|
|
477
|
Cc1cc-2nc3ccc(cc3oc2cc1=[N+](C)C)N
|
|
478
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
479
|
c1ccc-2c(c1)CCNc3c2cccc3
|
|
480
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
481
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
482
|
CSc1nccc(n1)c2cnoc2
|
|
483
|
C=CCN1C2CCCCC2C(C1O)C3=C4CCCCC4=NC3=O
|
|
484
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
485
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
486
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
487
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
488
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
489
|
[H]/N=C/1NC(=C2C(=Nc3ccc(nc3S2)OC)[N-]1)N
|
|
490
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
491
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
492
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
493
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
494
|
c1cc([nH]c1)/C=C/c2cccs2
|
|
495
|
CC(=O)N[C@@H]1CCC2CCCCC2-C3C1CC(=O)CCC3
|
|
496
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
497
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
498
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
499
|
Cc1nc(cs1)c2nnc(o2)N
|
|
500
|
Cc1ccc(nc1)C[S@@](=O)C2=NC3=CS[C@H](C3=N2)C(=O)C
|
|
501
|
CN(CCO)c1cnccn1
|
|
502
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
503
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
504
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
505
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
506
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
507
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
508
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
509
|
|
|
510
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
511
|
c1c[nH]nc1Nc2c(nc(c(n2)Cl)Cl)Cl
|
|
512
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
513
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
514
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
515
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
516
|
CCO[C@@H]1C2C(NC3CCCCC3N2)-C4CCCCC4N1C(=O)C
|
|
517
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
518
|
Cn1ccnc1COc2ccc(cc2)N
|
|
519
|
c1cnccc1c2cc3c(o2)CCNC3=O
|
|
520
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
521
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
522
|
|
|
523
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
524
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
525
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
526
|
c1ccc(cc1)c2nc(=[NH2+])sn2c3ccccc3
|
|
527
|
Cc1c2cc(ccc2[nH]n1)F
|
|
528
|
c1ccc(cc1)c2c3c(nc(s3)C#N)n(n2)c4ccccc4
|
|
529
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
530
|
c1cc(sc1)c2c(n[n-]n2)C#N
|
|
531
|
Cc1c(c(n(n1)C)Sc2ccc(cc2)Cl)C(=O)N
|
|
532
|
Cn1c(=O)n(oc1=O)c2ccccc2
|
|
533
|
CC1=NN(C(=O)C1)C(=O)c2ccc(cc2)O
|
|
534
|
CCO/C=C/[C@@](CNC(=O)C1CC1)(C(F)(F)F)O
|
|
535
|
Cc1ccccc1CC(=O)N2CCCS2(=O)=O
|
|
536
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
537
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
538
|
|
|
539
|
c1ccc(cc1)c2c3c(c(ncn3)[O-])sn2
|
|
540
|
c1ccc2c(c1)Oc3cc4cc[nH]c4cc3S2
|
|
541
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
542
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
543
|
CCOC(=O)C1CN(C2C1C(=O)[C@@H](CC(=O)N2)C(=O)OCC)C
|
|
544
|
Cc1c2c(cc([o+]1)c3ccccc3)CCC2
|
|
545
|
COC(=O)c1cc2c(cccn2)oc1=O
|
|
546
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
547
|
c1ccc(cc1)Cc2cc(=O)c(c[nH]2)C(=O)N
|
|
548
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
549
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
550
|
C1CCN(C1)c2c(=O)c(nsn2)Cl
|
|
551
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
552
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
553
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
554
|
CC(=O)Nc1nc2ccc(cc2s1)c3nc4ccccc4o3
|
|
555
|
CN(C)c1nc(nc(n1)N(C)S(=O)(=O)OC)N(C)C
|
|
556
|
CCNC(=O)n1cc(c(n1)c2ccccc2)c3ccncn3
|
|
557
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
558
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
559
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
560
|
Cc1cc(no1)n2cnc(n2)c3cnoc3C
|
|
561
|
|
|
562
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
563
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
564
|
c1cc(oc1)c2nc3c(cc(cn3n2)C(=O)N4CCCC4)N
|
|
565
|
c1ccc2c(c1)ncn2c3c(nc4nccn4n3)C(F)(F)F
|
|
566
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
567
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
568
|
c1ccc2c(c1)CCCN2c3c(cno3)C#N
|
|
569
|
C1CNC2C3CNC4C(C3NN2C1)CCS4
|
|
570
|
c1ccc(cc1)c2cc3cnsc3o2
|
|
571
|
c1ccc2c(c1)c(ncn2)N3CCNc4c3cccc4
|
|
572
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
573
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
574
|
CCOc1ccc(cc1)n2c3c4ccccc4[nH]c3cc(c2=O)N
|
|
575
|
Cc1cnc(o1)COc2ccccc2
|
|
576
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
577
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
578
|
c1ccc2c(c1)nc3n2CN=C4N3CN(CN4)CCO
|
|
579
|
CC1(CC2=C(c3c1c[nH]n3)Sc4ccccc4N2)C
|
|
580
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
581
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
582
|
c1ccc2c(c1)c3c([nH]2)CCOC3
|
|
583
|
CC1(C(=Cc2c(nc3ccccc3n2)O1)OC)C
|
|
584
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
585
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
586
|
c1ccc(cc1)n2c(=O)cc3n(c2=O)CCN3
|
|
587
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3cc4c(s3)CCC4
|
|
588
|
c1cc2c(cc1I)C3=C(C2)C(=O)NCC3
|
|
589
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
590
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
591
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
592
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
593
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
594
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
595
|
CCOC(=O)N=c1oc2ccccc2o1
|
|
596
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
597
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
598
|
|
|
599
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
600
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
601
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
602
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
603
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
604
|
CC#CC1CCC(S1)C#CC#CC=C
|
|
605
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
606
|
c1ccc(cc1)n2c(c-3sc4ccccc4nc3c2=O)[O-]
|
|
607
|
c1ccc2c(c1)N(CCO2)C(=O)n3ccnc3
|
|
608
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
609
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
610
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
611
|
COC(=O)c1cc2c(o1)Sc3ccccc3NC2=O
|
|
612
|
C[C@@H]1Nc2ccccc2-c3n1c4ccccc4n3
|
|
613
|
C1CCC2C(C1)C[C@@H]3[C@@H]2C4CCCCC4N3
|
|
614
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
615
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
616
|
CCCn1c2=N[C@@H](C(=c2c(=O)[nH]c1=O)[O-])C
|
|
617
|
Cc1c(nc(nc1N2CCC=CC2)C3CC3)NC4CC4
|
|
618
|
C[C@@H]1Cc2ccccc2N1c3c(c(=O)c3=O)c4ccccc4
|
|
619
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
620
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
621
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
622
|
Cc1c(cco1)c2nnc(n2C)SC
|
|
623
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
624
|
c1ccc2c(c1)C[C@@H]2c3ccccn3
|
|
625
|
CN1CC(=O)N=C1/N=C(/C23CC4CC(C2)CC(C4)C3)[O-]
|
|
626
|
CC(C)(C)c1cc(no1)n2c(=O)c3ccccc3[nH]c2=O
|
|
627
|
COC(=O)CCc1c[nH]cn1
|
|
628
|
CCCCc1[nH]cc([nH+]1)CO
|
|
629
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
630
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
631
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
632
|
c1ccc2c(c1)c3cc(nn3c(n2)[O-])c4ccccn4
|
|
633
|
CC[C@@H]1Cn2c3c(cccc3S1)cc(c2=O)c4ccccc4
|
|
634
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
635
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
636
|
CC1(O[C@@H]2[C@@H]3C=C[C@H]([C@@H]2O1)C(=C3C(=O)[O-])C(=O)OC)C
|
|
637
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
638
|
Cc1c(c(on1)c2ccc(cc2O)OC)c3cc4ccccc4o3
|
|
639
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
640
|
C(#N)c1c(c2c(c(sc2s1)C#N)N)N
|
|
641
|
CC1CC2CC3CCCNN3C2NN1
|
|
642
|
CCn1cc(cn1)c2cc[nH]n2
|
|
643
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
644
|
Cc1cc(n(n1)c2nc3c(c4ccccc4[nH]3)nn2)C
|
|
645
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
646
|
Cc1c(n(c(c1c2[nH]c3ccccc3n2)N)C4CCCC4)C
|
|
647
|
Cc1cccc(n1)C#CCSc2ccccc2
|
|
648
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
649
|
CC1=C[C@@H](c2c(=O)[nH]c(=O)[nH]c2O1)c3ccccc3
|
|
650
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
651
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
652
|
c1ccc(cc1)c2nnnn2c3ccn(n3)c4ccccc4
|
|
653
|
c1ccc(cc1)OCc2ccco2
|
|
654
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
655
|
C[C@H]1C=C[C@H]2CCCC[C@H]2[C@@H]1C3CC(C(C(=O)O3)CO)OC
|
|
656
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
657
|
c1ccc(cc1)C2=NC(=O)CN2
|
|
658
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
659
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
660
|
Cc1ccc(cc1)N(CC2=NCNC2)c3cccc(c3)O
|
|
661
|
Cc1ccc(cc1)n2cnc(=O)c(n2)C#N
|
|
662
|
CCc1nc(n(c(=O)n1)c2ccccc2)N3CCOCC3
|
|
663
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
664
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
665
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
666
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
667
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
668
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
669
|
Cn1c2c(cn1)nc[nH]c2=O
|
|
670
|
c1ccc2c(c1)CC=N[C@@H]2Cn3c4ccccc4nn3
|
|
671
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
672
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
673
|
CC1C2C(ON1)CSC3CCCCC3C2=O
|
|
674
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
675
|
C[C@@]1(C(OC(=O)N1CCc2c[nH+]c[nH]2)(C)C)O
|
|
676
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
677
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
678
|
C[C@@H]1Nc2ccccc2-c3c(nc(nn3)SC)O1
|
|
679
|
CC1NCC(N1CC2CCCCC2)[C@@H](C3CCCO3)O
|
|
680
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
681
|
Cn1cnc2c(c1=O)noc2C(=O)c3ccccc3
|
|
682
|
c1cc(cnc1)Nc2nsc(=O)n2c3cccnc3
|
|
683
|
CCCCOC1=N[C@@H]2[C@@H](CNC2=O)CO1
|
|
684
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
685
|
c1cc(oc1)c2ccnc(n2)N
|
|
686
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
687
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
688
|
C[C@@H]1CCCN(C1)C(=O)c2c(c(ns2)c3ccccn3)N
|
|
689
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
690
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
691
|
c1ccc-2c(c1)CC(=O)n3c2nc4c3cccc4
|
|
692
|
c1cc([nH]c1)C(=O)c2ccco2
|
|
693
|
c1ccc2c(c1)c3c(c(no3)N)c(=O)[nH]2
|
|
694
|
Cc1cc(nc(n1)C2=[NH+]c3ncnn3[C@@H](N2)c4ccccc4)C
|
|
695
|
COc1ccccc1Oc2c(=O)[nH]c(nc2[O-])c3ncccn3
|
|
696
|
c1ccc2c(c1)n3c(o2)[nH+]c(nc3=O)N
|
|
697
|
CCO[C@@H]1C=CC=Cc2c1cccc2
|
|
698
|
CNC(=O)OCC#CCOC(=O)NC
|
|
699
|
Cc1c2cnnc(c2c([nH]1)C)[O-]
|
|
700
|
CCOC1=N[C@@H]2CCCC[C@@H]2N1
|
|
701
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
702
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
703
|
Cc1cn2c(nc(nc2n1)c3ccccc3)N
|
|
704
|
Cc1c2c(n(n1)c3ccccc3)N[C@@H](C=C2C)C
|
|
705
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
706
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
707
|
c1cc2c(c(c1)Cl)[nH]nn2
|
|
708
|
C1CCC(CC1)C2=NCC=CC3C2CCCC3
|
|
709
|
Cc1c(sc(c1C#N)Nc2c(nc3ccccc3n2)Cl)C
|
|
710
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
711
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
712
|
c1ccc2c(c1)nc3c(n2)Sc4c(cccn4)O3
|
|
713
|
Cc1ccc(cc1C)c2c(cccn2)OC3(CCCC3)C(=O)[O-]
|
|
714
|
c1cc(oc1)c2csc(n2)CC#N
|
|
715
|
c1ccc(cc1)C2=C(NNC(=[NH2+])N2)c3ccccc3
|
|
716
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
717
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
718
|
c1ccc(cc1)C2=NCC(=O)O2
|
|
719
|
CC1CCN(CC1)c2ncc3c(n2)-c4cn(nc4NCC3)C
|
|
720
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
721
|
COC(=O)[C@@H]1CC/C(=C(C#N)/C2=N[C@@H](CC2)C(=O)OC)/N1
|
|
722
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
723
|
CCc1nc(cs1)CSc2nccn2C
|
|
724
|
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
|
|
725
|
Cc1ccc(nc1C)c2ccoc2
|
|
726
|
CSc1nnc(n1c2ccccc2)c3cc4c([nH]3)cco4
|
|
727
|
Cc1ccc(nc1)n2cnnn2
|
|
728
|
CNc1c2c(c3c(n1)sc(n3)NC)n(cn2)C
|
|
729
|
CCc1cc2c(s1)S[C@@H](NC2=O)c3ccccc3
|
|
730
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
731
|
c1ccc(cc1)Nc2c3cn[nH]c3ncn2
|
|
732
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
733
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
734
|
CCOC(=O)/[NH+]=c/cc(cc(o1)O)O
|
|
735
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
736
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
737
|
Cc1c(c(on1)C)n2c(c(nn2)C(=O)C)C
|
|
738
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
739
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
740
|
c1nc(nn1CCC#N)N=N=N
|
|
741
|
CCN1Cc2nc3ccccc3c(=O)n2C=C1C
|
|
742
|
C/C(=C/C1CCCCC1)/CCC2=N[C@@H](CO2)C(=O)OC
|
|
743
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
744
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
745
|
c1ccc2c(c1)-c3ccccc3C2n4c5ccccc5nn4
|
|
746
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
747
|
CCOC(=O)c1c(n(c(=O)s1)c2ccccc2)N
|
|
748
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
749
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
750
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
751
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
752
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
753
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
754
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
755
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
756
|
COC1=CC(=O)O[C@@H](C1)C2CCCO2
|
|
757
|
c1ccc-2c(c1)CCc3c2nnn3c4ccc(cc4)Br
|
|
758
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
759
|
CC(C)Ncccccc/c1=NC(C)C
|
|
760
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
761
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
762
|
c1ccc(cc1)C2=CC(=NC(=O)[C@@H]2C#N)c3ccccc3O
|
|
763
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
764
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
765
|
COC(=O)c1ccc(o1)[N-]S(=O)(=O)c2ccccc2
|
|
766
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
767
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
768
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
769
|
CNC1=N[C@H](N(S1)c2ccccc2)c3ccccc3
|
|
770
|
c1cc2c(cc1c3c4ccoc4ccn3)OCCO2
|
|
771
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
772
|
[H]/N=c/n(nc(s1)C(=O)C)c2ccccc2
|
|
773
|
c1ccc(cc1)COc2c(nccn2)N
|
|
774
|
Cc1ccc(o1)[C@@H]2C[C@@H](n3c(ccn3)N2)C(F)(F)F
|
|
775
|
Cc1c([nH]n(c1=O)C2=NCCN2)c3ccccc3
|
|
776
|
c1ccc-2c(c1)Cc3c2nc4ncnn4c3
|
|
777
|
C1CCC(CC1)/C=C/C2NC(NC(N2)N)N
|
|
778
|
Cc1cc(nc(n1)C)n2c3ccccc3nn2
|
|
779
|
c1cc2c(=O)[nH]c3c(n2c1)ccs3
|
|
780
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
781
|
CN1C2C(C(=O)N(C1=O)C)NC3C4CCCCC4OC3N2
|
|
782
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
783
|
[H]/N=C/1NC(N(S1)CC2CCCCC2)C3CCCCC3
|
|
784
|
C[C@@]12CCC(=O)N1c3ccccc3N2
|
|
785
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
786
|
|
|
787
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
788
|
COc1cc(=O)nc(o1)c2ccco2
|
|
789
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
790
|
COc1ccc2c(c1)c(c([nH]2)C(=O)OC)N
|
|
791
|
CC(C)(C)c1cc(c(s1)C(=O)OC)CSc2ccccn2
|
|
792
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
793
|
Cc1nnnn1C2CCCCC2
|
|
794
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
795
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
796
|
c1cc2nnc(n2cc1C(F)(F)F)c3nccs3
|
|
797
|
C1=CC=CC(C=C1)NC(=O)N
|
|
798
|
C1CCC(CC1)C2NNC(O2)C3C4CCCCC4SN3
|
|
799
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
800
|
CN1CCN(CC1)C2=Cc3ccccc3Sc4c2cccc4
|
|
801
|
c1cc(nn2c1ncc(c2=O)N)N3CCCC3
|
|
802
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
803
|
c1c[nH]nc1C2CCCCC2
|
|
804
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
805
|
|
|
806
|
CC1CC2N3C1[C@@H]([C@@H]([C@@H]3C=CC2)C(=O)OC)C(=O)OC
|
|
807
|
c1cc2c(cc1N)NCC[NH2+]2
|
|
808
|
c1ccc(c(c1)[C@H]2[C@@H](CCC(=O)N2)NCC3=COCCO3)F
|
|
809
|
CC(C)c1nc([nH]n1)CC#N
|
|
810
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
811
|
c1cc(oc1)Cn2c(=O)c3cnc(nc3nc2[O-])n4ccnc4
|
|
812
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
813
|
c1ccc2c(c1)nc(o2)c3ccco3
|
|
814
|
c1cc(oc1)[C@@H]2Nn3c(nnc3S2)c4ccc(cc4)O
|
|
815
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
816
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
817
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
818
|
C[C@@H]1C(=O)N=C(N1c2nc(nc(n2)OC)NC(C)C)N
|
|
819
|
C/C=C/[C@@H]1OCC[C@@](O1)(C)C(=O)C2CCCCC2
|
|
820
|
CN(C)C1=NC(=N[S@@](=N1)N(C)C)c2ccccc2
|
|
821
|
|
|
822
|
c1cc(ccc1[C@@H]2c3cc4c(cc3NC5=C2C(=O)OC5)OCO4)F
|
|
823
|
c1ccc2c(c1)c(=O)n3c4ccccc4oc3n2
|
|
824
|
Cc1cc(nn1C)c2nnc(s2)NC
|
|
825
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
826
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
827
|
CC1=Nc2c(c(n(n2)c3ccccc3)O)C(=O)CC1
|
|
828
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
829
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
830
|
CC1CC(=O)N(C(=O)O1)C2CCCCC2
|
|
831
|
c1ccc(cc1)n2cc3c(n2)-c4ccccc4NC3
|
|
832
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
833
|
COc1cc2c(cc1OC)-c3cccn3CC2
|
|
834
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
835
|
CC1=C([C@@H](C(=C(O1)N)C(=O)OC)c2ccc[nH]2)C(=O)N
|
|
836
|
Cc1csc(n1)c2c(c(c(s2)SC)c3cc[nH]n3)C
|
|
837
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2nc(s3)C
|
|
838
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
839
|
Cc1c2c([nH]n1)NC3=C([C@@H]2C)C(=O)OC3
|
|
840
|
Cn1c(ncn1)c2csc(n2)c3ccncc3
|
|
841
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
842
|
c1cnc(c2c1scc2)C#CCO
|
|
843
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
844
|
CN(C)c1c2c(oc(=O)c1Cl)-c3ccccc3SCC2
|
|
845
|
CC(C)(C)OC(=O)N1CCC(=CC1)C#Cc2ccccn2
|
|
846
|
C=Cn1cccc1c2ccco2
|
|
847
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
848
|
Cc1nc(n(n1)C(=O)c2cccs2)C
|
|
849
|
CC(C)(C)C(=O)/N=c/1
c2n(s1)ccs2
|
|
850
|
c1ccc(cc1)COc2c(non2)N
|
|
851
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
852
|
C=CC[C@@H]1CC=C[C@H](N1C(=O)c2[nH]ccn2)c3ccccc3
|
|
853
|
c1ccc(cc1)C2=NCCCO2
|
|
854
|
c1ccc2c(c1)-c3c(c(on3)Cl)CCS2
|
|
855
|
CN1CC[C@@H](c2c1cccc2)n3c4ccccc4nn3
|
|
856
|
CC(=O)c1n[nH]c2n1ncc2
|
|
857
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
858
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
859
|
COC1CC2C(CC1OC)-C3CCCC4C3N(CC4)CC2
|
|
860
|
CC(=O)c1c(c2ccccc2o1)n3cccc3
|
|
861
|
|
|
862
|
c1ccc(cc1)[C@@H]2OCc3c(ccc(n3)CO)O2
|
|
863
|
CN(c1ccc(cc1)OC)c2c3c(ccn2)ccs3
|
|
864
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
865
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
866
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
867
|
c1ccc(cc1)C2=Nc3ccccc3C(=O)OC2
|
|
868
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
869
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
870
|
Cc1c(nc(nn1)N)/C=C/c2cc(cc3c2cccc3)O
|
|
871
|
CC1=CC(=C2C=CC(=[O+]C)C=C2)C=C(S1)c3ccccc3
|
|
872
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
873
|
c1cnc(c(n1)C(=O)[C@@H]2CCOC2)Cl
|
|
874
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
875
|
CCOc1/c(=N/Cc2ccccc2)/c(=O)c1[O-]
|
|
876
|
c1ccc2c(c1)c(=O)[nH]c3n2nnc3
|
|
877
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
878
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
879
|
Cn1c(cc(c1SC)c2ccco2)OC
|
|
880
|
Cn1c(nc(n1)Br)n2ccnc2
|
|
881
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
882
|
CCCCN1[C@@H](C(=C(C1=O)C)C)Sc2ccc(cc2)OC
|
|
883
|
C[C@@H]1c2nc3ccccc3c(=O)n2CN1c4ccc(cc4)F
|
|
884
|
c1ccc(cc1)OC2=CC(=O)OC23CCCCC3
|
|
885
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
886
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
887
|
c1c2c(cnc1Cl)CCN2
|
|
888
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
889
|
CCCC(=O)NC1CCC(C2C1[C@@H]3[C@@H]2CCCCC3)O
|
|
890
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
891
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
892
|
CSc1c(cc(c(=O)[nH]1)c2cccs2)C#N
|
|
893
|
c1ccc(cc1)C2=NCc3nncn3-c4c2cc(cc4)Cl
|
|
894
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
895
|
C1CCC(CC1)C2=C3[C@@H](CC4C2CCCC4)CNC3=O
|
|
896
|
COC(=O)C1=NCC(=O)Nc2c1cccc2
|
|
897
|
c1ccc(cc1)N(CCC#N)c2c(c3ccccc3s2)Cl
|
|
898
|
c1ccc(cc1)/N=c/n(c(cs2)O)c3ccccc3
|
|
899
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
900
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
901
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
902
|
c1csc2c1c(ncn2)n3ccnc3
|
|
903
|
|
|
904
|
Cc1ccc2c(c1)nc3c(n2)sc(=O)s3
|
|
905
|
Cc1nc(c(n1C)O[C@@H]2CCCCO2)SCc3ccccc3
|
|
906
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
907
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
908
|
C1CCC(CC1)N2C=CC=CC=C2
|
|
909
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
910
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
911
|
COC(=O)C1=C([C@@H]2CC[C@H]1O2)C(=O)OC
|
|
912
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
913
|
c1cc(ccc1N)Oc2nccs2
|
|
914
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
915
|
c1ccc(cc1)c2ncc(o2)c3ncco3
|
|
916
|
c1ccc(cc1)N2C3=CCCC[C@H]3C(=O)C2=O
|
|
917
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
918
|
COCC/N=c/c(=C2C=CC(=O)C=C2)[nH]c3=CNC=Cn31
|
|
919
|
c1cc(oc1)c2nccs2
|
|
920
|
C1COCCN1C2C(=O)NC(SN2)N
|
|
921
|
c1cc(cnc1)c2nc3c4c(ncn3n2)CCC4
|
|
922
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
923
|
CCOC(=O)c1c2c3ccccc3[nH]c2n4c1scc4C
|
|
924
|
C[C@@H](c1ccno1)Oc2ccccc2
|
|
925
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
926
|
c1ccc2c(c1)N3CN(CN=C3N2CO)Cc4ccc(cc4)Cl
|
|
927
|
c1ccc2c(c1)nnn2c3nc4ccccc4s3
|
|
928
|
CC1(C=C(c2ccccc2O1)n3ccccc3=O)C
|
|
929
|
CCCCC1C(OC(N1)C)CC=C
|
|
930
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
931
|
c1ccc2c(c1)C(=O)O[C@@]23Oc4cccnc4S3
|
|
932
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
933
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
934
|
c1ccc(cc1)S(=O)(=O)CC2=Nc3cccn3C2=O
|
|
935
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
936
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
937
|
[H]/N=c/n(c(c(s1)C#N)N)c2ccccc2
|
|
938
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
939
|
c1cc(sc1)CCNc2ncccn2
|
|
940
|
Cn1c(=O)cc([nH]1)c2ccccc2
|
|
941
|
CC(C)(C)OC(=O)N1CCCC(=O)c2c1nn(c2)C
|
|
942
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
943
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
944
|
CCn1cncc1c2nnc3n2cccc3Cl
|
|
945
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
946
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
947
|
CC1(C=Cc2c(c3ccccc3[nH]c2=O)O1)C
|
|
948
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
949
|
c1cnc(cn1)c2nnc(o2)N
|
|
950
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
951
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
952
|
C[C@@H]1C[C@@H](n2c(ncn2)N1)c3ccccc3
|
|
953
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
954
|
c1ccn(c1)c2c(c(c(o2)c3cccs3)C#N)c4cccs4
|
|
955
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
956
|
C1CC2C(CC1BR)C3CCNC(C3[NH]2)C4=NCCC4
|
|
957
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
958
|
c1(c(non1)N)c2nnc(o2)N
|
|
959
|
CCnccnc(/c1=Nc2ccc(cc2)OC)N3CCOCC3
|
|
960
|
Cc1nc(cs1)c2cc(no2)CO
|
|
961
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
962
|
CC#CC#Cc1cccc(=O)o1
|
|
963
|
CCC1C(=O)NCCNC1=O
|
|
964
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
965
|
c1ccc(cc1)C(=O)c2ncco2
|
|
966
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
967
|
CC(=O)Nc1cc2c(s1)C3(CCCCC3)CC(=O)N2
|
|
968
|
Cc1cccc(n1)C#CCNc2ccccc2
|
|
969
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
970
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
971
|
CCCCN1CCc2cccc(c2SC1)C
|
|
972
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
973
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
974
|
c1cc([nH]c1)/C=N/c2ccc(cc2)F
|
|
975
|
Cc1nc(cs1)c2ccc[nH]2
|
|
976
|
c1ccc2c(c1)nc3c(n2)C4=CC=CC5=CC=C[C@@H]3[C@@H]54
|
|
977
|
c1ccc2c(c1)nn(n2)Cc3ccco3
|
|
978
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
979
|
Cc1c(cno1)c2csc(n2)C
|
|
980
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
981
|
CC1=C[C@@H](c2c(=O)c(c(oc2S1)N)C#N)c3ccoc3
|
|
982
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
983
|
CCCNC(=O)c1c(sc2c1oc(c2)c3ccccc3)C
|
|
984
|
CCN(CC)C(=O)/C=C(/CCCC#N)Sc1ccccc1
|
|
985
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
986
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
987
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
988
|
CCOC(=O)C1=C(O[C@@]2(C[C@H]1[C@H]3CO[C@@H]2O3)O)C
|
|
989
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
990
|
C=CCn1cc(ccc1=O)c2ccco2
|
|
991
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
992
|
c1ccc2c(c1)cccc2[C@H]3C(=O)c4ccsc4O3
|
|
993
|
Cc1cc(oc1)c2ccccc2
|
|
994
|
c1ccc(cc1)S[C@@H]2c3ccccc3C(=O)O2
|
|
995
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
996
|
Cc1nc(sn1)C2=CCCN(C2)C
|
|
997
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
998
|
Cc1c(c2ccccc2n1C)c3cc(n[nH]c3=O)c4ccccc4
|
|
999
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
1000
|
CC(=O)C1C2C(NC(N1)C(=O)C)N(CN2)C(=O)C
|
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