(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CNC1=[NH+][C@@H](N(S1)c2ccccc2)c3ccccc3
|
|
2
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
3
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
4
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
5
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
6
|
Cc1nnc(n1C)Sc2c(c3ccccc3[nH]c2=O)NC4CC4
|
|
7
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
8
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
9
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
10
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
11
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
12
|
C[C@@H]1CC2=C(CNc3ccccc3N2)C(=O)O1
|
|
13
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
14
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
15
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(cnn3)N2)c4ccco4
|
|
16
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
17
|
C=Cc1c(c(c2n1cccc2)c3c4ccccc4c(=O)[nH]n3)N
|
|
18
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
19
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
20
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
21
|
c1ccc(cc1)N2CCN3[C@@H]2c4ccccc4C3=O
|
|
22
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
23
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
24
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
25
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
26
|
c1ccc2c(c1)-n3c(n[nH]c3=O)CS2
|
|
27
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
28
|
C1Cc2c(sc3c2c(c(c(=O)[nH]3)C#N)N)C1
|
|
29
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
30
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
31
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
32
|
C1CCC2C(C1)CCC3C(C4CCCCC4[NH]3)C2
|
|
33
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
34
|
CCOC(=O)N1CCC(=CC1)c2c(nn(c2N)C)C
|
|
35
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
36
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
37
|
c1c2c(c(=O)[nH]n1)Sc3cn[nH]c(=O)c3S2
|
|
38
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
39
|
Cc1[nH]c(=O)c2c3c(c(=O)oc2n1)nns3
|
|
40
|
Cc1ccc(cc1)OS(=O)(=O)c2cc(n(c2)C)C(=O)N
|
|
41
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
42
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
43
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
44
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
45
|
c1ccc(cc1)[C@@H]2c3nnnn3-c4ccccc4C2=O
|
|
46
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
47
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
48
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
49
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
50
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
51
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
52
|
c1ccc(cc1)/C=C/Cn2c(=O)c3c(cccn3)oc2=O
|
|
53
|
|
|
54
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
55
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
56
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
57
|
COC(=O)c1c2c3c(nsc3s1)SCC(=N2)O
|
|
58
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
59
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
60
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
61
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
62
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
63
|
c1c2c(sc1C(=O)Nc3nc[nH]n3)CCCCCC2
|
|
64
|
COC(=O)c1cc2c([nH]1)cc(nc2Cl)Cl
|
|
65
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
66
|
|
|
67
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
68
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
69
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
70
|
c1ccc2c(c1)CN(c3cccnc3O2)c4ccc(s4)C(=O)[O-]
|
|
71
|
|
|
72
|
c1ccc-2c(c1)Cc3c2nncc3
|
|
73
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
74
|
Cc1ccc(cc1)N(CC2=NCNC2)c3cccc(c3)O
|
|
75
|
COc1ccc(cc1)[C@@H]2C(=NC(=O)N2)c3ccc(cc3)OC
|
|
76
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
77
|
C/C(=Nc1ccccc1)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
78
|
COc1ccccc1/N=c/2cccccc2O
|
|
79
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
80
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
81
|
c1c2c(nc(n1)N)CCCC2=O
|
|
82
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
83
|
CC1(Nc2ccnn2C(=N1)Oc3ccccc3)C
|
|
84
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
85
|
|
|
86
|
Cc1cc(=O)nc2n1n(c(c2)[O-])c3ccccc3
|
|
87
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
88
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
89
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
90
|
COc1nc(nc(n1)Sc2ccc(cc2)N)OC
|
|
91
|
C[C@@H]1Cc2nc(cc(=O)n2N1c3ccccc3)[O-]
|
|
92
|
Cc1cc2c(c(n1)C)c(=O)[nH]n2C(=O)C
|
|
93
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
94
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4s3
|
|
95
|
Cc1c(c(n(n1)C)Sc2ccc(cc2)Cl)C(=O)N
|
|
96
|
Cc1c(snn1)C(=O)NCc2nc(no2)C
|
|
97
|
Cc1c(c(n(n1)c2ccccc2)[O-])/C=C/C=Nc4c3cccc4
|
|
98
|
CC1=C[C@@H](n2c(ncn2)N1)c3ccccc3F
|
|
99
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
100
|
C1CCC(CC1)CC2CCC[NH]2
|
|
101
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
102
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
103
|
C[C@@H](c1cccc(c1)F)Oc2cccc3n2c(nn3)c4c[nH]cn4
|
|
104
|
c1cc(cnc1)Cc2c3[nH]c4c(c(=O)n3[nH]c2=O)CCC4
|
|
105
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
106
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
107
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
108
|
c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
|
|
109
|
C1CCC(CC1)/C=C/C=C/C2C(=O)[NH]C(=O)[NH]N2
|
|
110
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
111
|
c1ccc2c(c1)CNc3ccccc3O2
|
|
112
|
|
|
113
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
114
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
115
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
116
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
117
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
118
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
119
|
Cc1c(c(n[nH]1)n2ccnc2)N
|
|
120
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
121
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
122
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
123
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
124
|
COC(=O)c1c([nH]c(c1C(=O)OC)c2ccsc2)C#N
|
|
125
|
c1ccc(cc1)[C@@H]2C=C(n3c(ncn3)N2)c4ccccc4
|
|
126
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
127
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
128
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
129
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
130
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
131
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
132
|
|
|
133
|
Cc1cc(c(c(=O)o1)[C@@H]2c3ccccc3C(=O)O2)O
|
|
134
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
135
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
136
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
137
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
138
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
139
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
140
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
141
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
142
|
c1ccc(cc1)Cn2c(nnc2Cl)C3CC3
|
|
143
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
144
|
c1cc(oc1)Cn2c3c(nc2Cl)CCC3
|
|
145
|
C[C@@H]1c2nc3ccccc3n2[C@@H](O1)c4ccccc4
|
|
146
|
c1cc(cnc1)CCNCc2cscn2
|
|
147
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
148
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
149
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
150
|
|
|
151
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
152
|
C[C@@H]1C[C@@H](n2c(ncn2)N1)c3ccccc3
|
|
153
|
|
|
154
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
155
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
156
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
157
|
Cc1nc2cccc3c2n1CCN3
|
|
158
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
159
|
|
|
160
|
Cc1c(c(n[nH]1)C)[C@@H]2C[C@@H](C=C2)O
|
|
161
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
162
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
163
|
|
|
164
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
165
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
166
|
c1cnn(c1)CCSc2nncs2
|
|
167
|
Cc1c(n2ccccc2n1)Sc3ccccc3
|
|
168
|
Cc1ccc(o1)[C@@H]2C[C@@H](n3c(ccn3)N2)C(F)(F)F
|
|
169
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
170
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
171
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
172
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
173
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
174
|
Cc1c2cnsc2n(n1)c3ccccc3
|
|
175
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
176
|
c1ccc(cc1)Oc2ccccc2c3cc4c(nc3)nn[nH]4
|
|
177
|
|
|
178
|
c1cn[nH]c1[C@@H]2CCCN(C2)S(=O)(=O)N3CCCCCC3
|
|
179
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
180
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
181
|
CNC(=O)Nc1ccc2c(c1)nnn2C
|
|
182
|
Cc1c2c(c3ccccc3n1)SCC2
|
|
183
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
184
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
185
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
186
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
187
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
188
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
189
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
190
|
CC1=N/C(=C/c3ccccc3C(=O)O2)/C(=O)O1
|
|
191
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
192
|
CCOc1ccc2c(nc(nc2c1)/N=C/NCCC(=N3)[O-])C
|
|
193
|
CC(=O)Nc1c(c(cs1)C2=C[C@@H]3[C@@H](C=C2)OCO3)C#N
|
|
194
|
c1ccc2c(c1)nc3n2-c4ccc(cc4CS3)N
|
|
195
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
196
|
C1CCC2C(C1)-C3CCCNC3S2(=O)=O
|
|
197
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
198
|
CC(C)(C)OC(=O)N1CCC(CC1)Oc2ccc(=O)[nH]n2
|
|
199
|
c1ccc2c(c1)Nc3c(cccn3)S2
|
|
200
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
201
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
202
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
203
|
Cc1c2cnc3ccccc3n2nn1
|
|
204
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
205
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
206
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
207
|
|
|
208
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
209
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
210
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
211
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
212
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
213
|
c1ccc2c(c1)[C@@H](CC(=O)N2)C(=O)N3CCn4c(ncn4)C3
|
|
214
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
215
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
216
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
217
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
218
|
CC(=O)N1C[C@@H](C=C1c2ccccc2)c3ccccc3
|
|
219
|
c1cnc(nc1)N2CCC[C@H]2c3nc(no3)c4cncnc4N
|
|
220
|
C1CCc2c(c3c(c([nH]c3s2)C#N)N)C1
|
|
221
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
222
|
Cc1ccc(cc1)S(=O)(=O)Nn2c3ccccc3nn2
|
|
223
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
224
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
225
|
C1CCC2C(C1)C[C@@H]3[C@@H]2C4CCCCC4N3
|
|
226
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
227
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
228
|
Cc1c2ccn(c(=O)c2n(n1)C)CC(=O)NC3CC3
|
|
229
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
230
|
Cc1nnc(c2n1c3ccoc3c2)[O-]
|
|
231
|
c1ccc(cc1)[C@@H]2CC(=O)Nc3c2snc3C(=O)[O-]
|
|
232
|
CNC1CNC2CCCCC2N1
|
|
233
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
234
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
235
|
c1ccc(cc1)N2Cc3nc(=O)[nH]n3C2=O
|
|
236
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
237
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
238
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
239
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
240
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
241
|
c1c2c(nc(n1)N)SCC2
|
|
242
|
C1CCCC(C1)C(=C/C2=C/C3CCNCC3)[C@@H](C4CCNCC4)O
|
|
243
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
244
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
245
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
246
|
c1ccc2c(c1)CC[NH+]=C(N2)N3CCOCC3
|
|
247
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
248
|
COc1ccc2c(c1)CC[C@@H]3[C@@H]2O[C@@H](O3)c4cccnc4
|
|
249
|
Cc1c(cc2cc[nH]c2n1)C#N
|
|
250
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
251
|
C=CCN1[C@@H]2[C@@H](C(=O)[C@@]3([C@@]2(C=CC=C3)O)O)NC1=O
|
|
252
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
253
|
Cc1c2c(c(no2)c3ccccc3)nc(n1)C
|
|
254
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
255
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
256
|
c1[nH]c(=O)c2c(n1)c(c3n2CCCC3)C#N
|
|
257
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
258
|
c1ccc(cc1)C2=C(NNC(=[NH2+])N2)c3ccccc3
|
|
259
|
CNC1=N[C@H](N(S1)c2ccccc2)c3ccccc3
|
|
260
|
c1ccc2c(c1)cnn(c2=O)Cc3nnnn3C4CC4
|
|
261
|
c1cc2cccc3c2c(c1)NCN3
|
|
262
|
c1ccc(cc1)c2c([nH]nc2c3[nH]c4ccccc4n3)c5ccco5
|
|
263
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
264
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
265
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
266
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
267
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
268
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
269
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
270
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
271
|
Cc1c(c([nH]n1)n2cccc2)C(=O)[O-]
|
|
272
|
Cc1c2c(ccc(n2)NC(=O)C)n(n1)C
|
|
273
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
274
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
275
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
276
|
CC(=O)Nn1cnc2c1cccc2
|
|
277
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
278
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
279
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
280
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
281
|
CCC/N=c/c(=N/c2cccnc2)/c(c1O)O
|
|
282
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
283
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
284
|
c1ccc2c(c1)nn(n2)c3cc(n[nH]3)O
|
|
285
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
286
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
287
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
288
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
289
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
290
|
c1ccc2c(c1)Oc3cc4cc[nH]c4cc3S2
|
|
291
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
292
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
293
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
294
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
295
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
296
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
297
|
c1ccc2c(c1)-c3c4c(cccc4sn3)C2=O
|
|
298
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
299
|
COC(=O)c1c(c2c([nH]1)c3ccccc3n4c2nnn4)N
|
|
300
|
Cc1c(sc(n1)c2ccccc2)c3nnc(n3C)SC
|
|
301
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
302
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
303
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
304
|
Cc1cc(nc(n1)Sc2nc(nc(n2)Cl)NC)C
|
|
305
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
306
|
Cc1c2c([nH]c(=O)n(c2=O)Nc3ccc(cc3)O)sn1
|
|
307
|
C[C@@H]1NC(=O)c2ccccc2O1
|
|
308
|
Cc1nn(c(=O)c2n1ccn2)CC(=O)OC
|
|
309
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
310
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
311
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
312
|
c1ccc2c(c1)NC3=C([C@@H](S2)c4ccc(cc4)F)C(=O)OC3
|
|
313
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
314
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
315
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
316
|
c1ccc2c(c1)c3c([nH]2)CCC3
|
|
317
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
318
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
319
|
c1ccc(cc1)NC2=NN/C(=Nc3ccccc3)/[C@H]2Cl
|
|
320
|
c1cc(cnc1)C(=O)c2ccco2
|
|
321
|
CC1=NC(=O)[C@@H](C=C1c2ccc3nccn3c2)C#N
|
|
322
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
323
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
324
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
325
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
326
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
327
|
Cc1[nH]c2c3ccccc3sc2n1
|
|
328
|
c1cc2cc(sc2nc1)CO
|
|
329
|
c1ccc(cc1)[S@@]2=NS(=O)(=O)c3c2cccc3
|
|
330
|
Cc1cc(n(n1)c2c(c([nH]n2)C)N)C
|
|
331
|
c1ccc(cc1)[C@@]2(CCn3c4c2cccc4nn3)O
|
|
332
|
c1cc2c(cc1Cl)ncn3c2nn(c3=O)CC(=O)N
|
|
333
|
Cn1nc(nn1)c2ccc(c(c2)N)O
|
|
334
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
335
|
Cn1c(c(c(=O)[nH]c1=O)Oc2ccc(cc2Cl)F)N
|
|
336
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
337
|
|
|
338
|
c1c[nH]c2c1ncc(n2)Cl
|
|
339
|
C1CCC2C(C1)C3C([NH]2)C(=O)CCS3
|
|
340
|
|
|
341
|
CC(=O)N1Cc2c([nH]cn2)C[C@H]1C(=O)OC
|
|
342
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
343
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
344
|
Cc1c2c(c3ccccc3s2)c4c(n1)CC(C[C@@H]4O)(C)C
|
|
345
|
c1ccc2c(c1)Cc3cccnc3O2
|
|
346
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
347
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
348
|
Cc1c(noc1N2CCOC2=O)C
|
|
349
|
c1ccc2c(c1)-c3c(snn3)C2=O
|
|
350
|
CC(C)C(=O)N1CCN(CC1)Cn2cnnc2C#N
|
|
351
|
Cc1c2c(n(n1)c3ccccc3)sc(n2)C
|
|
352
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
353
|
CC1=[NH+]c2ccc(cc2-c3c(c4ccccc4[nH]3)N1)Cl
|
|
354
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
355
|
Cc1nc(c2n1nc[nH]c2=O)CC(C)C
|
|
356
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
357
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
358
|
c1ccc2c(c1)nc3n2C4(CCCC4)NC(=[NH+]3)N
|
|
359
|
CCOC(=O)c1c(c(ccc1N(C)C)[C@@H]2C=CNC(=O)N2)C
|
|
360
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
361
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
362
|
Cn1c(cnc1Cn2c3ccccc3ncc2=O)Cl
|
|
363
|
CNc1ccccc1[C@@H]2C=CC(=C2)c3ccccc3
|
|
364
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
365
|
CC1=C([C@@H](N2C(=N1)N=CN2)c3ccccc3)C(=O)N
|
|
366
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
367
|
CCSc1ccc(nn1)N
|
|
368
|
c1ccc2c(c1)nc(c3n2nnn3)Nc4ccccc4O
|
|
369
|
CC1CC2CC3CCCNN3C2NN1
|
|
370
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
371
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
372
|
Cc1cc(nc(n1)Nn2c(cc(c(c2=O)C(=O)C)[O-])C)C
|
|
373
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
374
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
375
|
CNC(=O)Oc1ccccc1
|
|
376
|
c1ccc2c(c1)CCc3c(cc(cc3O2)N)N
|
|
377
|
Cc1[nH]nc(n1)c2ccccc2
|
|
378
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
379
|
COC(=O)N(CC#C)[C@@H](CC=C)c1ccoc1
|
|
380
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
381
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
382
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
|
383
|
|
|
384
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
385
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
386
|
Cc1c(=O)n2c(nn1)SC[C@@H]2CSc3ccccc3
|
|
387
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
388
|
Cn1c(nnc1SC)Cn2c3ccccc3sc2=O
|
|
389
|
CCc1nnc(c2n1c(nn2)c3ccc(cc3)F)[O-]
|
|
390
|
c1cnnc2c1c(c(s2)C(=O)N)N
|
|
391
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
392
|
CCOc1ccc(nn1)Sc2cc(nc(n2)SCC)C
|
|
393
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
394
|
c1ccc2c(c1)[C@@H](C(=O)N2)c3c(cc(cn3)C(F)(F)F)Cl
|
|
395
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
396
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
397
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
398
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
399
|
C(#N)c1c(c2c(c(n1)Cl)sc(=O)s2)Cl
|
|
400
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
401
|
C[C@@H]1Cc2c3c(cccc3N1)ncn2
|
|
402
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
403
|
c1cc(oc1)C2=NN3C(=N[C@H]4CCCC[C@H]4C35CCCCC5)N2
|
|
404
|
Cc1cn(c(n1)c2cccnc2)c3ccc(cc3)S(=O)(=O)C
|
|
405
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
406
|
CC1=CC(=O)O[C@@H]1Cc2ccncc2
|
|
407
|
CCc1c(nc(n1C#N)CC)C
|
|
408
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
409
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
410
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
411
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
412
|
CCSc1nnc2n1CCN2c3ccccc3
|
|
413
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
414
|
CC1NC(NO1)C2CN3C(C2C(C)C)C(=O)NC[NH]3
|
|
415
|
C[C@@H]1c2nc3ccccc3n2CN(CO1)c4ccc(cc4)F
|
|
416
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
417
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
418
|
c1cc(ncc1C#N)NCc2nccs2
|
|
419
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
420
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
421
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
422
|
Cc1cn(cn1)c2cccnc2
|
|
423
|
c1ccc2c(c1)Cn3c(cnn3)C=N2
|
|
424
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
425
|
Cc1c2c(on1)C=C(CC2)c3ccccc3
|
|
426
|
CCn1c2ccccc2nc(c1=O)[C@H]3c4ccccc4NC3=O
|
|
427
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
428
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2ncn3c4ccccc4)O
|
|
429
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
430
|
CC1C(N2C(NCN2)NN1)N(C)C3CCCCC3
|
|
431
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
432
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
433
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
434
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
435
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
436
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
437
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
438
|
|
|
439
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
440
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
441
|
Cc1c2c(oc(c2c(nn1)C)C)C
|
|
442
|
CC(=O)c1c(c2ccccc2o1)n3cccc3
|
|
443
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
444
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
445
|
C1Cc2c3c(nnc4c3c(nn2)CCC4)C1
|
|
446
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
447
|
c1ccc(cc1)c2c3cc(cnn3c(n2)N)C(=O)c4ccccc4O
|
|
448
|
c1cc(cnc1)c2cc(c3c(n2)nc(nc3[O-])N)C(F)(F)F
|
|
449
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
450
|
Cc1cc(nc(n1)C2=[NH+]c3ncnn3[C@@H](N2)c4ccccc4)C
|
|
451
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
452
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
453
|
CC(C)(C)OC(=O)Nc1c[nH]nc1
|
|
454
|
Cc1c(sc(c1C#N)Nc2c(nc3ccccc3n2)Cl)C
|
|
455
|
c1ccc2c(c1)/C(=Cc3c(n4c(nc3=O)scn4)N)/C=N2
|
|
456
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
457
|
COC(=O)C1=NCC(=O)Nc2c1cccc2
|
|
458
|
c1c2c(nc(n1)N)CCOC2
|
|
459
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
460
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
461
|
c1c2c(n[nH]c1=O)CCOC2
|
|
462
|
c1ccc2c(c1)CCc3ccccc3NC2
|
|
463
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
464
|
c1ccc2c(c1)Nc3cc(ccc3S2)c4cc[nH]n4
|
|
465
|
C1CCC2C(C1)NC3=C(N2)O[C@@H](C3=O)C4CCCO4
|
|
466
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
467
|
Cn1c2cccc3c2c(n1)-c4ccccc4C3=O
|
|
468
|
C1CCC2C(C1)CC3CCCC4C3[C@@H]2N=C4
|
|
469
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
470
|
c1ccc2c(c1)-c3c[nH]c4c3c(ccc4)C2=O
|
|
471
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
472
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
473
|
CC1=C([C@@]2(c3ccccc3-c4c2nc(o4)N)C(=O)N1)C(=O)OC
|
|
474
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
475
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
476
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
477
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
478
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
479
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
480
|
Cc1nn(c(=O)c2n1c3c(c2)ccs3)CCCC#N
|
|
481
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
482
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
483
|
c1cc(ccc1C(=O)c2nnc(s2)Cl)Cl
|
|
484
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
485
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
486
|
c1ccc2c(c1)C[C@@]3(c4ccccc4C=C3NC2=O)O
|
|
487
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
488
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
489
|
c1cc(ccc1c2csc3n2cnc-4ncnc34)Cl
|
|
490
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
491
|
CSC1C2C3C(C(NNN3)CL)SC2NS1
|
|
492
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
493
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
494
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
495
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
496
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
497
|
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
|
|
498
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
499
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
500
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
501
|
C1C(SC(N1)N)[C@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
502
|
Cc1c2ccccc2nc(n1)C
|
|
503
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
504
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
505
|
c1ccc2c(c1)C[NH2+]C2=C(C#N)C#N
|
|
506
|
CNc1nc2c(s1)[C@@H](CC(=N2)O)c3ccccc3
|
|
507
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
508
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
509
|
CS(=O)(=O)n1c2ccccc2c(n1)I
|
|
510
|
c1cnoc1/C=C/c2c(cncc2Cl)Cl
|
|
511
|
c1cc(n2c1c(ncn2)N)Br
|
|
512
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
513
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
514
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
515
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
516
|
c1cc(ccc1[C@@H]2[N-]S(=O)(=O)N=C3N2CCC3)F
|
|
517
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
518
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
519
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
520
|
CC1(c2ccccc2N([C@@]13C=Nc4c5cccnc5ccc4O3)C)C
|
|
521
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
522
|
CC(C)(C)OC(=O)N1CCCCc2c1nccc2
|
|
523
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
524
|
C1CCN(C1)c2c(c(ns2)Cl)C#N
|
|
525
|
CC1C(=O)C(C2CCCCN2N1)C3CCCCC3
|
|
526
|
C1Cc2c(nc(nc2c3c4c(nc(n3)N)CCC4)N)C1
|
|
527
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
528
|
c1cn2c(=O)c3cncnc3sc2n1
|
|
529
|
c1cc2c(cc1c3ccc(s3)C(=O)N)NCCO2
|
|
530
|
|
|
531
|
|
|
532
|
Cc1c2c(n3c(n1)c(cn3)C#N)N(CC2)Cc4ccco4
|
|
533
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
534
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
535
|
Cc1c2cc(cnc2n(n1)C)[N-]S(=O)(=O)c3cccs3
|
|
536
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
537
|
CC(=O)N1CN(Cn2c1nc3c2cccc3)CCc4ccccc4
|
|
538
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
539
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
540
|
c1csc2c1c(ncn2)n3ccnc3
|
|
541
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
542
|
c1ccc2c(c1)CC[C@@]3(C2)Nc4ccccc4S3
|
|
543
|
CC(=O)Nc1cc2cccnc2sc1=O
|
|
544
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
545
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
546
|
C1CCC2C(C1)C(=O)N-3C(N2)CSC4C3CCCC4
|
|
547
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
548
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
549
|
C1CCC(CC1)S(=O)(=O)C2=C[C@@H](C[C@@H]2O)O
|
|
550
|
CC(=CCC/C(=C/Cn1ccnc1)/C)C
|
|
551
|
c1ccc2c(c1)c3c([nH]2)-c4ccccc4OCC3
|
|
552
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
553
|
Cc1coc2n1cc(n2)c3ccc(cc3)Cl
|
|
554
|
Cn1c(c(c(n1)Cl)Cl)Oc2ccccc2
|
|
555
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
556
|
C[C@@H]1C=C([C@H]2C(=N[NH+]=C2N1)c3ccccc3)C
|
|
557
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
558
|
Cc1cc(n(n1)C(C)C)OC(=O)N(C)C
|
|
559
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
560
|
CC(=O)n1cc(cc1c2ccccc2)OC(=O)C
|
|
561
|
Cc1c2ccccc2c(=O)on1
|
|
562
|
Cc1c(c([nH]c1/C=C/2C(=C(C(=O)N2)C)C=C)OC)CCC(=O)[O-]
|
|
563
|
CC1=N[C@H](C(=O)C1)c2ccccc2
|
|
564
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
565
|
CC1CCC(CC1)S(=O)(=O)N2CCN3C2C(CN3)C#N
|
|
566
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
567
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
568
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
569
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
570
|
Cc1c(=O)n2c(nn1)n(cn2)Cc3ccccc3
|
|
571
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
572
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
573
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
574
|
CCCc1c(c(n(n1)C)[O-])C(=O)c2cc3ccccc3s2
|
|
575
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
576
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
577
|
|
|
578
|
c1ccc2c(c1)-c3c(cn[nH]3)CC(=O)N2
|
|
579
|
COC(=O)c1c(cc(=O)n2c1CCCCC2)[O-]
|
|
580
|
c1ccc2c(c1)C(=O)O[C@@]23Oc4cccnc4S3
|
|
581
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
582
|
Cc1cc2nc(nc(=O)n2o1)Oc3ccccc3
|
|
583
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
584
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
585
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
586
|
c1ccc(cc1)NC(=O)NC23CC4CC(C2)CC(C4)C3
|
|
587
|
CN(C)c1nc(nc(n1)OC)Nn2cnnc2
|
|
588
|
Cc1c(c(n[nH]1)C)Sc2ccccc2
|
|
589
|
c1ccc(cc1)c2nnnn2CCc3ccccn3
|
|
590
|
CCc1nc([nH]n1)NC(=O)c2c(n[nH]n2)c3ccccc3
|
|
591
|
C1CCC(CC1)C2=NCC=CC3C2CCCC3
|
|
592
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
593
|
C[C@@H]1N([C@@H]2c3cccc4c3c(ccc4)[C@@H]2O1)c5ccccc5
|
|
594
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
595
|
Cn1c(c(sc1=O)/C=C/2C=Nc3c2cccc3)O
|
|
596
|
c1ccc2c(c1)CCC(=C2)S(=O)(=O)N
|
|
597
|
c1ccc2c(c1)CCc3ccccc3N2
|
|
598
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
599
|
c1ccc2c(c1)c(=O)n(s2)c3nccs3
|
|
600
|
c1cc(n[nH]c1=O)NC2CC2
|
|
601
|
c1cc2cccc3c2c(c1)N=C4N3C(=O)OC4
|
|
602
|
c1ccc-2c(c1)CCc3c2cn[nH]3
|
|
603
|
c1ccc2c(c1)c3c([nH]2)C[C@@H]4[C@@H](C3)c5ccccc5NC4=O
|
|
604
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
605
|
|
|
606
|
c1ccn(c1)c2ccc(nn2)Cl
|
|
607
|
c1ccc2c(c1)nc(c3n2cnn3)Nc4cc(ccc4O)Cl
|
|
608
|
C1CCC2C(C1)C(=O)C3C(O2)CC4(CCCCC4)OC3=O
|
|
609
|
CCNc1nc(nc(n1)Cl)Sc2nnc(s2)SC
|
|
610
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
611
|
c1coc2c1C(=O)[C@@H]3CCC(=O)N3C2
|
|
612
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
613
|
CC1=Nc2cccc3c2c1ccc3
|
|
614
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
615
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
616
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
617
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
618
|
CC(C)S(=O)(=O)c1c(c(=O)[nH]s1)c2ccccc2
|
|
619
|
C1CC(CCC=C1)CCC(=O)N
|
|
620
|
c1ccc(cc1)Cn2cnc3c(c2=O)nsc3C(=O)NC4CC4
|
|
621
|
Cc1c(sc2c1/c(=[NH+]/Cc3cn4ccccc4n3)/nc[nH]2)C
|
|
622
|
Cc1[nH]cc(n1)c2ccccc2
|
|
623
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
624
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
625
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
626
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
627
|
COC(=O)Nc1cn2c(n1)ccc(n2)C(=O)N
|
|
628
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
629
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
630
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
631
|
c1cc2c(nc1)C(=O)c3ccc(cc3CC2)Cl
|
|
632
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
633
|
Cc1[nH]c(=O)c2c(n1)C[NH2+]C2
|
|
634
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
635
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
636
|
Cc1ccc2c(c1)Nc3c(c(=O)c3=O)N2
|
|
637
|
c1cc(cnc1)NCc2csnn2
|
|
638
|
CC1=CC(=O)Nc2cccc3c2n1nc3
|
|
639
|
c1ccc(cc1)c2c(scn2)Cn3cnc4cnccc4c3=O
|
|
640
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
641
|
CC(C)c1nc(on1)[C@@H]2Cc3c([nH]c[nH+]3)CN2C(=O)C
|
|
642
|
c1ccc2c(c1)N3C[C@H](CN=C3S2)O
|
|
643
|
C1=N[C@@H]2[C@@H](C(=O)N1)N=CN2[C@@H]3[C@@H]([C@@H]([C@@H](O3)CO)O)O
|
|
644
|
CC(C)(C)S(=O)(=O)c1cn[nH]c1N
|
|
645
|
COCCC/N=C/[C@@H](C(=O)C1=O)NCCO
|
|
646
|
CN(C)c1nc(nc(n1)N)Cn2cc[nH+]c2
|
|
647
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
648
|
c1cc(ccc1N)Sc2nncs2
|
|
649
|
Cc1c(=O)n2c(csc2nn1)c3ccccc3
|
|
650
|
Cc1c(cnn1c2ccccc2)c3nnc(o3)[O-]
|
|
651
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
652
|
Cc1cc(n(n1)CSc2ccccc2)C
|
|
653
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
654
|
|
|
655
|
Cc1c2c(n3c(n1)c(cn3)C#N)SCC2
|
|
656
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
657
|
Cc1cc(nc2c1c(n[nH]2)S(=O)(=O)N3CCC(CC3)C)C
|
|
658
|
CC[C@@H]1Nc2ccccc2N1c3ccc(cc3)Cl
|
|
659
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
660
|
CNC=CN/C1=CC(=O)c2ccccc2
|
|
661
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
662
|
COc1cc(nc(n1)Oc2ccccc2c3ccno3)OC
|
|
663
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
664
|
Cc1ccc2c(c1)[C@@H]3[C@@H]4CC[C@@H](C4)[C@@H]3[S@@](=O)N2
|
|
665
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
666
|
C1CCC(C(C1)C2CCCCC2C3=NC3)C4=NC4
|
|
667
|
Cc1ccc(cc1)[C@@H]2Cc3c(c[nH]n3)C(=O)C2
|
|
668
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
669
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
670
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
671
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
672
|
CC1=C2CCOC2=Nc3ccccc3O1
|
|
673
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
674
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
675
|
c1ccc(cc1)C(=O)Nc2cc[nH]n2
|
|
676
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
677
|
c1ccc(cc1)c2c3c(n[nH]c3nnc2c4ccccc4)N
|
|
678
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
679
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
680
|
Cc1nnc(s1)[C@@H]2CCCN(C2)C(=O)C
|
|
681
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
682
|
Cc1cc(c(c(c1)C)OS(=O)(=O)n2cncn2)C
|
|
683
|
|
|
684
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
685
|
CCCCn1c(c(c2c1ncn(c2=[NH2+])c3nccs3)C)C
|
|
686
|
Cc1cc(=O)n2c(n1)CCCCC2
|
|
687
|
CC1C2C(NN1C)CCOC2=O
|
|
688
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
689
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
690
|
CCc1nc(cn1/C(=C/C(=O)n2cc(nc2CC)C)/[O-])C
|
|
691
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
692
|
c1ccc(cc1)COc2c(nccn2)N
|
|
693
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
694
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
695
|
c1cnccc1c2n[nH]c(=O)s2
|
|
696
|
C/C(=C(/C)OC(=O)C)/NC(=O)C
|
|
697
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
698
|
Cc1cc(nc(n1)Sc2c(c(nc(c2F)F)F)F)C
|
|
699
|
c1ccc(cc1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)[C@@H]4OC[C@H]3O4
|
|
700
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
701
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
702
|
C[C@@H](Cc1ccco1)NC(=O)C
|
|
703
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
704
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
705
|
c1ccc2c(c1)[C@@H]3[C@H]4C3C(=O)NC2c5c4cccc5
|
|
706
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
707
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
708
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
709
|
c1cc2c3c(c(ncn3)n4cccn4)sc2nc1
|
|
710
|
c1c(cn[nH]1)CS(=O)(=O)N
|
|
711
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
712
|
CCc1nnc(o1)COC(=O)cc([n-]s/c2=NC)C
|
|
713
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
714
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
715
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
716
|
C[C@@H]1Cc2c(cc(n2C)c3nnc(n3c4ccccc4)SC)O1
|
|
717
|
C1C[C@@H]2N=Cc3c(c(sc3N2C1)C(=O)N)N
|
|
718
|
c1ccc2c(c1)C(=O)[C@@]3([C@@]2(Nc4c(non4)N3)O)O
|
|
719
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
720
|
C[C@@H]1CCC2C(C(=O)[NH]C(N2)N)N1
|
|
721
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
722
|
c1ccc2c(c1)C(=O)c3nccn3C2=O
|
|
723
|
CC1=NC2=CC(=NC3=CC(=NC(=C1)C32)C)C
|
|
724
|
c1ccc(cc1)n2c(cnn2)Cn3cnc4ccccc4c3=O
|
|
725
|
c1ccc2c(c1)cc3n(c2=O)CCCCC3
|
|
726
|
c1ccc(c(c1)[C@@H]2c3ccsc3[C@@H]4CCCC[C@@H]4O2)N
|
|
727
|
c1ccc(cc1)[C@@H]2[C@@H]([C@@H](OC3=C2CCCC3)N)C#N
|
|
728
|
c1ccc(cc1)[C@@H]2COC(=O)N2
|
|
729
|
CCc1nc(c2n1c(ccc2)C)N3CCCC3=O
|
|
730
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
731
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
732
|
CN1[C@@H](C[C@@H]2C=CO[C@@H]2C1=O)c3ccc(cc3)OC
|
|
733
|
CCc1nc(n(c(=O)n1)c2ccccc2)N3CCOCC3
|
|
734
|
CC(C)/C=C/C1=CC2=C(C1)Cc3c2cccc3
|
|
735
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
736
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
737
|
c1c2c(n[nH]c1=O)CCCC2
|
|
738
|
c1cnc2cc3c(cc2n1)[C@@H]4C[C@H]3C(=O)NC4
|
|
739
|
C[C@@]1(COC(=N1)COc2ccccc2)CO
|
|
740
|
Cc1nc2ccc(cc2s1)n3c(c(nn3)[O-])C#N
|
|
741
|
c1cc2c(nc1)Sc3cccnc3S2
|
|
742
|
CC1C(C(ON1)C)C2=CCCCC3C2CCCC3
|
|
743
|
Cn1c2c(cn1)c(ncn2)n3cccn3
|
|
744
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
745
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
746
|
Cc1[nH]c(=O)c(c(n1)Sc2cccn2C)C(F)(F)F
|
|
747
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
748
|
COC1CC2C(CC1O)-C3C(CNO3)CCC2
|
|
749
|
C1CNC2C3CNC4C(C3NN2C1)CCS4
|
|
750
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
751
|
C1CCC2C(C1)C=C[C@@H]3[C@H]2[C@@H]4CCCC[C@@H]4O3
|
|
752
|
Cc1c(c(on1)N)[C@@](c2nccn2C)(C(F)(F)F)O
|
|
753
|
c1cc(sc1)[C@@H]2[C@@H](C(=NC(=O)N2)[O-])C#N
|
|
754
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
755
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
756
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
757
|
C1CC2C(CC1C3NNC(O3)N)SCN2
|
|
758
|
CSc1nnc(c(=O)n1N)/C=C/c2cccs2
|
|
759
|
Cn1c(cnc1c2cc(=O)c3ccccc3o2)Cl
|
|
760
|
c1c2c([nH]c(=O)c1C#N)CCOC2
|
|
761
|
C=CCSc1nc2c(c(n1)c3cccs3)CCCC2
|
|
762
|
CN1C(=O)C2CC(C(=O)OC2N(C1=O)C)C(=O)N
|
|
763
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
764
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
765
|
CCOC1(Cc2c1cc3ccccc3n2)OCC
|
|
766
|
c1cn2c(cc1=O)C(=O)NCC2
|
|
767
|
CCS(=O)(=O)NCCn1cccn1
|
|
768
|
c1ccc(cc1)CNn2cnnn2
|
|
769
|
CCOC(=O)/C=C/1[C@@](C2CCCCC2O1)(C)O
|
|
770
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
771
|
c1c2n(c(=O)[nH]c1=O)[C@@H]3[C@@H]([C@@H]([C@H]([C@@H]2CCO)O3)O)O
|
|
772
|
c1ccc2ccccc(c1)C2(C#N)Br
|
|
773
|
CCOc1c2c(cc([nH]2)C(=O)OCC)nc(n1)OCC
|
|
774
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
775
|
c1ccc2c(c1)CSc3ccccc3N2
|
|
776
|
C1CCc2c([nH]nc2O)CC1
|
|
777
|
CNC(=O)N/C=C/c1ccco1
|
|
778
|
c1ccc2c(c1)nnn2c3nnns3
|
|
779
|
C1CCC(CC1)n2c(=O)c(n[nH]2)C#N
|
|
780
|
Cc1cc-2n(c1)CCn3c2ccc3
|
|
781
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
782
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
783
|
C1CCC(CC1)[C@@H]2CCC(=O)N2
|
|
784
|
Cc1c2cnnc(n2cn1)Nc3cccnc3
|
|
785
|
|
|
786
|
C/C=C/1C(=O)[NH]/C(=C/C2CCCCC2)/C(=O)[NH]1
|
|
787
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
788
|
CC(C)(C)c1ccc(=O)[nH]n1
|
|
789
|
C[C@@H]([C@@H]1[C@@H]2CCOC3(N2C1=O)CCCCC3)O
|
|
790
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
791
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
792
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
793
|
C[C@@H]1C2=C(CC(=O)N=C2C)C(=O)N1Cc3ccccc3
|
|
794
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
795
|
CCOC(=O)c1nc2c(s1)NCCCC2
|
|
796
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
797
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
798
|
CCN(CC)/C(=C/C(=O)OCC)/C1CC([NH]C1C)C
|
|
799
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
800
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
801
|
CC1(Cc2c(nc(c(n2)N)C(=O)OC)CO1)C
|
|
802
|
c1cc(sc1)C(=O)/C=C/2C(=O)NCCN2
|
|
803
|
c1cc2c(cc1C#N)CCCC=C2
|
|
804
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
805
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
806
|
Cn1c2nnc(n2nn1)c3ccccc3
|
|
807
|
COc1c(nccn1)N2CCC(CC2)NS(=O)(=O)C
|
|
808
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
809
|
Cc1c(nc(c(n1)C(=O)NC)NC)CCC(=O)[O-]
|
|
810
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
811
|
Cc1nc(c2n1ccnc2Cl)[C@@H]3CCOC3
|
|
812
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
813
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
814
|
Cc1c(scn1)c2[n-]c3cc(cnc3n2)Br
|
|
815
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
816
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
817
|
c1c[nH]c2c1cc3c(c2)OCO3
|
|
818
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
819
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
820
|
c1ccc2c(c1)N=C(CN2C(=O)NCC(=O)[O-])O
|
|
821
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
822
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
823
|
c1ccc2c(c1)C(=O)Nc3ccccc3N2
|
|
824
|
c1ccc(cc1)[C@@H]2C(=N2)c3ccccc3
|
|
825
|
Cc1nc-2c(s1)Cc3c2ccc(c3)OC
|
|
826
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
827
|
C[C@@]12CC(=O)NC1=Nc3ccccc3S2
|
|
828
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
829
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
830
|
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C
|
|
831
|
C1Cc2c(non2)-c3c1non3
|
|
832
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
833
|
c1ccc2c(c1)nnn2CN3CSc4c3cccc4
|
|
834
|
Cc1cc2c(c(=O)o1)[C@@H](Sc3ccccc3N2)c4ccco4
|
|
835
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
836
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
837
|
c1cc(sc1)CCc2c(cco2)C(=O)[O-]
|
|
838
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
839
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
840
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
841
|
CCOC(=O)c1c(c([nH]n1)C)N
|
|
842
|
CCn1c(cc(n1)NC(=O)[C@@H]2c3ccccc3OCO2)C
|
|
843
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
844
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
845
|
CC1=CC(=O)Nc2c(cccn2)O1
|
|
846
|
CC1(CC2=C(c3c1c[nH]n3)Sc4ccccc4N2)C
|
|
847
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
848
|
C1CN2C3C(C(=O)[NH]C2N1)SCCN3
|
|
849
|
CC(=O)N1CCO[C@@H]1c2c(c(c(s2)Cl)Cl)Cl
|
|
850
|
Cc1cc2c(o1)ccc3c2non3
|
|
851
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
852
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
853
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
854
|
COC1=C(COC1=O)CC2CCCCC2
|
|
855
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
856
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
857
|
Cn1c(cc(=O)n(c1=O)C)Cn2ccccc2=O
|
|
858
|
c1ccc2c(c1)c3c([nH]2)CCOC3
|
|
859
|
CCNC(=O)Oc1c2ccccc2on1
|
|
860
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
861
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
862
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
863
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
864
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
865
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
866
|
C1C#C/C=CC#CC[C@@H]([C@@H]1CO)CO
|
|
867
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
868
|
c1ccc2c(c1)ncc3n2ncc3
|
|
869
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
870
|
CC1(C=C(c2cnccc2O1)N3CCCC3=O)C
|
|
871
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
872
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
873
|
CCOC(=O)[C@@H]1[C@@H](N=C(N=C1C)O)/C=C/c2ccccc2
|
|
874
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
875
|
CC(=O)N1[C@H]2C[C@@H]([C@H]1c3ccccc3)[C@@H]2OC(=O)C
|
|
876
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
877
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
878
|
c1ccc2c(c1)CNC(=O)CN2
|
|
879
|
c1c(c(c(=O)n(n1)Cc2c(snn2)Cl)Cl)Cl
|
|
880
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
881
|
CNC(=O)c1c(n(nn1)C)Sc2c(nns2)C(=O)NC
|
|
882
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
883
|
c1ccc-2c(c1)CN[C@@H](c3n2ccc3)c4ccc(cc4)F
|
|
884
|
Cc1nnc(s1)c2cc3ccccc3n2C
|
|
885
|
Cc1ccc(c2c1n3n2c(=O)n(c3=O)C)C
|
|
886
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
887
|
C=CCN1[C@@H]2C=CC=C[C@@H]2C(=O)C1=O
|
|
888
|
c1ccc2c(c1)c3c([nH]2)cccc3O
|
|
889
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
890
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
891
|
Cc1c(sc(n1)C)c2cc[nH]n2
|
|
892
|
c1ccc2c(c1)C[C@@H]([C@@H]2Sc3ncccn3)O
|
|
893
|
CCCCC1=N[C@@H]2[C@@H](c3c(c(ncn3)OC)S2)C4=C1CCC4
|
|
894
|
c1ccc2c(c1)c(c3c(n2)CCC3)n4cccn4
|
|
895
|
c1ccc2c(c1)[C@@H]3N(C2=O)c4ccccc4S3
|
|
896
|
CC1CC(C/C(=[NH+]/C2CCCCC2)/O1)O
|
|
897
|
Cc1cccn2c1nc(c2c3nnc(n3C)SCC=C)C
|
|
898
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
899
|
|
|
900
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
901
|
Cc1cccc2c1[nH]c3c2OC(CC3=O)(C)C
|
|
902
|
|
|
903
|
Cc1nn2cc(nc2s1)Cn3cnc4c(c3=O)cccc4OC
|
|
904
|
COc1ccc(cc1)C2=NCSc3n2ncn3
|
|
905
|
|
|
906
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
907
|
c1ccc(cc1)N(CCC#N)c2c(c3ccccc3s2)Cl
|
|
908
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
909
|
CCNC(=O)[C@@H](C)n1cnnc1C#N
|
|
910
|
C1CC2(C1)C[C@@](NC(=O)N2)(C(F)(F)F)O
|
|
911
|
Cn1c(ccn1)[C@@H]2C(=C(C(=O)O2)[O-])c3ccc4ccccc4n3
|
|
912
|
c1ccc(cc1)c2cc3c(nccn3n2)Cl
|
|
913
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
914
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
915
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
916
|
c1cc(ccc1c2c3ccoc3ccn2)C(=O)N
|
|
917
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
918
|
c1c(nn2c1OCCC2)CO
|
|
919
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
920
|
CNc1c2c(c3c(n1)sc(n3)NC)n(cn2)C
|
|
921
|
Cc1nc(cs1)c2ccc3c(c2)CCN3
|
|
922
|
Cc1c-2c(on1)CCc3c2n(nc3C(=O)[O-])C
|
|
923
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
924
|
Cc1nnc(s1)N2CCOC2=O
|
|
925
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
926
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
927
|
c1ccc(cc1)[C@@H]2C=C[C@@H]3COCC3=C2
|
|
928
|
c1c[nH]c2c1sc(c2)C(=O)[O-]
|
|
929
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
930
|
CC(=O)c1ccc2=c3cc(ccc3=c2c1)C(=O)C
|
|
931
|
c1cc2cccc3c2c(c1)C=C3
|
|
932
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
933
|
c1ccc2c(c1)N[C@@H](O2)c3cccs3
|
|
934
|
c1cc(cc2c1cc[nH]2)Cl
|
|
935
|
CCc1cc2cnsc2s1
|
|
936
|
CC(=O)O[C@@H]1CC([C@H](O1)OCc2ccccc2)(F)F
|
|
937
|
c1cc(ccc1c2c(ocn2)c3ccc4nncn4c3)F
|
|
938
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
939
|
Cn1cc(cn1)c2cc(on2)CO
|
|
940
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
941
|
Cc1c2c(n(n1)c3ccccc3)S[C@@H]2c4ccco4
|
|
942
|
CCCCC1=NC2(CCCC2)C(=O)C1
|
|
943
|
CS(=O)(=O)N1CC[C@@H](C1)c2[nH]c3cccnc3n2
|
|
944
|
CC1(Oc2cc(oc(=O)c2C(=O)O1)N3CCOCC3)C
|
|
945
|
CC1(NC(=O)[C@@H](O1)/C=C/C2CCCCC2)C
|
|
946
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
947
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
948
|
CCCCCCC1CN[NH]N1
|
|
949
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
950
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
951
|
c1ccc-2c(c1)NCc3n2ccc3
|
|
952
|
Cc1c(c(nc(c1Cl)C)S(=O)(=O)n2ccnc2)C#N
|
|
953
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
954
|
Cc1cc(n2c(n1)ncn2)[O-]
|
|
955
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
956
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
957
|
COc1ccc(cc1)C2=NNC(=C3C(=NN=C3N)N)O2
|
|
958
|
c1ccc(c(c1)C(=O)[C@@H]2C(=NN=N2)C(F)(F)F)O
|
|
959
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
960
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
961
|
CC1(c2ccc(cc2[C@H]([C@@H]1O)n3ccccc3=O)N)C
|
|
962
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
963
|
C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)CCNc2ccccn2
|
|
964
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
965
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
966
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
967
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
968
|
Cc1c(non1)OCCNC(=O)C23CC4CC(C2)CC(C4)C3
|
|
969
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
970
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
971
|
C/C(=C/CO)/C#CCN1CCCC1
|
|
972
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
973
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
974
|
Cc1c(cc/c(=NC(=O)C(C)C)/[nH]1)Br
|
|
975
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
976
|
Cc1c(nn(n1)C(=O)c2ccccc2)C
|
|
977
|
CS(=O)(=O)N[C@@H]1CCc2c1cccc2
|
|
978
|
c1ccc(cc1)[C@@]2(NC(=O)N3CCN=C3O2)C(F)(F)F
|
|
979
|
Cc1c(nccn1)c2ccn[nH]2
|
|
980
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
981
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
982
|
CC1CCCC(N1)C2[N-]NNN2
|
|
983
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
984
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
985
|
c1ccc2c(c1)C3c4ccccc4C2O3
|
|
986
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
987
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
988
|
|
|
989
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
990
|
CCc1nnc(s1)/N=C(/[C@@H](C2CCCC2)NC(=O)C)[O-]
|
|
991
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
992
|
CNC(=O)N1CCOC12CCCCC2
|
|
993
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
994
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC=C)CCn2cccn2
|
|
995
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
996
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
997
|
Cc1c(c(on1)C)COn2c3cc(ccc3nn2)C(F)(F)F
|
|
998
|
COC(=O)N1CCc2c(s[nH]c2=O)C1
|
|
999
|
Cc1c(c(=O)n(n1S(=O)(=O)C)C)CCO
|
|
1000
|
C1CCc2c(c3c(s2)C(=O)NCC3)C1
|
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