(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
2
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
3
|
Cn1c(c(c(=O)[nH]c1=O)Sc2nc3ccccc3s2)N
|
|
4
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
5
|
Cc1c(cnc(c1C#N)N)Cc2cc(ccc2OC)OC
|
|
6
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
7
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
8
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
9
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
10
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
11
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
12
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
13
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(cnn3)N2)c4ccco4
|
|
14
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
15
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
16
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
17
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
18
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
19
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
20
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
21
|
Cc1nnc(o1)c2nc3ccc(cc3c(n2)Cl)Cl
|
|
22
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
23
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
24
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
25
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
26
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
27
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
28
|
CCCOCCn1c2cc(ncc2nc(c1=O)Cl)Cl
|
|
29
|
CC(C)(C)OC(=O)NCc1c[nH]nc1
|
|
30
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
31
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
32
|
c1ccc(cc1)Oc2ccccc2c3cc4c(nc3)nn[nH]4
|
|
33
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
34
|
c1ccc(cc1)c2cc(no2)c3c(non3)N
|
|
35
|
Cc1c(c(=O)[nH]c(=O)[nH]1)c2cccc(c2)n3cccn3
|
|
36
|
c1ccc(cc1)N2CCN3[C@@H]2c4ccccc4C3=O
|
|
37
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
38
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
39
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
40
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
41
|
Cc1ccc(cc1OS(=O)(=O)c2c([nH]c(=O)s2)C)C(C)C
|
|
42
|
|
|
43
|
c1cc(cnc1)[C@@H]2Cc3cc(ccc3O2)C#N
|
|
44
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
45
|
c1ccc2c(c1)CCC(=C2)n3ccnc3
|
|
46
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
47
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
48
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
49
|
|
|
50
|
COc1ccc(cc1OC2CCCC2)c3ccc(nc3)C(=O)N
|
|
51
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
52
|
CN1CCN(CC1)C2=Nc3cc(ccc3Cc4c2cccc4)F
|
|
53
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
54
|
CCOC(=O)N1CCC(CC1)c2c(c(n[nH]2)O)C
|
|
55
|
c1ccc(cc1)c2cc(no2)c3ncon3
|
|
56
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
57
|
COc1cc(cc(c1OC)OC)c2cc(=O)[nH]c(=O)[nH]c2=O
|
|
58
|
c1cc2c(cc1Cl)ncn3c2nn(c3=O)CC(=O)N
|
|
59
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
60
|
Cc1c2c(nc3ccccc3n2)n(n1)c4nccs4
|
|
61
|
c1cnc(cn1)c2nnc(o2)N
|
|
62
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
63
|
c1ccc2c(c1)nc(s2)n3cnc(n3)C#N
|
|
64
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
65
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
66
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
67
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
68
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
69
|
Cc1ccn(n1)CC/N=C/[C@@H](C(=O)C2=O)NCCCOC
|
|
70
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
71
|
CCOC(=O)C1=C(C(=O)N(C1)c2ccccc2)N
|
|
72
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
73
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
74
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
75
|
Cc1ccc(s1)[C@@H]2CCCc3c2cccc3
|
|
76
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
77
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
78
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
79
|
COc1cc(nc(c1)C(=O)Nc2[n-]nnn2)c3ccc(cc3)N
|
|
80
|
CCc1nnc(s1)Nc2ccn(n2)Cc3ccccc3Cl
|
|
81
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
82
|
c1ccc(cc1)[C@@H]2NC(=[NH2+])Nc3n2c4ccccc4n3
|
|
83
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
84
|
c1c(nc[nH]1)C[C@@H]2C(=O)N3CCC[C@@H]3C(=O)N2
|
|
85
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
86
|
|
|
87
|
c1cc(cnc1)CCNCc2cscn2
|
|
88
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
89
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
90
|
c1cc(n[nH]c1=O)NC2CC2
|
|
91
|
|
|
92
|
Cc1csc(n1)c2nnc(o2)N
|
|
93
|
CC1(c2ccccc2C(=[O+]1)c3ccc(cc3)OC)C
|
|
94
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
95
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
96
|
COc1ccc(cc1)/C=C/C(=O)N=C(S2)CC(=O)C3CC3
|
|
97
|
CCCCCCC1CN[NH]N1
|
|
98
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
99
|
CC(C)/N=c/1ccccn1C(=O)COc2ccc(cc2)Cl
|
|
100
|
Cn1cc(nc1)S(=O)(=O)Oc2ccsc2C(=O)OC
|
|
101
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
102
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
103
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
104
|
CC1CC2CC3CCCNN3C2NN1
|
|
105
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
106
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
107
|
CC1NC(ON1)C2CNCCN2
|
|
108
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
109
|
Cc1ccc(cc1)N(CC2=NCNC2)c3cccc(c3)O
|
|
110
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
111
|
CCC1=Cn2c3ccccc3c4c2c(ccc4)C1
|
|
112
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
113
|
CSc1cc(nn1C(=O)Cc2ccccc2)c3ccc(cc3)F
|
|
114
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
115
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
116
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
117
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
118
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
119
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
120
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
121
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
122
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
123
|
Cc1c2c(oc(c2c(=O)n(n1)CC(=O)[O-])n3cccc3)C
|
|
124
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
125
|
CC(=O)N1C[C@@H](C=C1c2ccccc2)c3ccccc3
|
|
126
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
127
|
CCOC(=O)/C=C(/c1cnc2n1cccc2)C(F)(F)F
|
|
128
|
CC[C@@H]1Nc2ccccc2N1c3ccc(cc3)Cl
|
|
129
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
130
|
CN1CN(c2c1cccc2)CC(=O)c3ccccc3
|
|
131
|
c1ccc2c(c1)nc(o2)n3cnc(n3)C#N
|
|
132
|
CCCCn1c(nnn1)CN2c3cccc4c3c(ccc4)C2=O
|
|
133
|
C1CC(CCC1CC2CC(=O)C3C(S2)CCS3)F
|
|
134
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
135
|
COc1ccc(cc1)n2c3ccccc3nc2Cn4cnc(n4)C#N
|
|
136
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
137
|
Cc1ccccc1CN[C@@H]2COC[C@H]2c3ccc(cc3)F
|
|
138
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
139
|
c1cc(nnc1n2cncn2)[O-]
|
|
140
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
141
|
|
|
142
|
C=CCSc1cc(cc(c1C#N)c2ccccc2)C3CC3
|
|
143
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
144
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
145
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
146
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
147
|
C[C@@H]1C2C(CC(NC2[O-])OC(=O)C)C(=N1)OC(=O)C
|
|
148
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
149
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
150
|
COC(=O)c1cc-2c(s1)C(=O)c3c2cccc3
|
|
151
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
152
|
Cc1cc(nc(n1)n2c(cc(=O)[nH]c2=O)N)C
|
|
153
|
COC1CCCC2C1OC(=C(C2)C(=O)N)NC3CCCCC3
|
|
154
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
155
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
156
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
157
|
c1ccc2c(c1)N=CC=C(S2)c3cccnc3
|
|
158
|
C1CCC-2C(C1)-C3CCCC4C3C2CC(N4)CL
|
|
159
|
COC(=O)NS(=O)(=O)/C=C/N1C2CCCCC2C3C1CCCC3
|
|
160
|
c1cc(cnc1)C(=O)c2ccco2
|
|
161
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
162
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
163
|
Cc1ccc(cc1)/N=C/c3cccc(c3NC2=O)C
|
|
164
|
CCCCN1[C@@H](c2ccccc2C1=O)Sc3ccc(cc3)F
|
|
165
|
C[S@@](=NCn1c2ccccc2nn1)(=O)c3ccccc3
|
|
166
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
167
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
168
|
CCc1c(nco1)C(=O)N2CCC(CC2)c3cc(=O)[nH]c(n3)C
|
|
169
|
Cc1cc(nc(n1)C)n2c3ccccc3nn2
|
|
170
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
171
|
C1CCC2C(C1)C(N3C2SCC3)C4NC(NC(N4)F)F
|
|
172
|
Cc1nnc(s1)SCSc2ccccn2
|
|
173
|
COC(=O)c1c2cccc3c2c(o1)-c4ccccc4C3=O
|
|
174
|
Cc1c2c(n[nH]1)CC(C=C2)(C)C
|
|
175
|
c1cc(oc(=O)c1)c2cccnc2
|
|
176
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
177
|
c1ccc2c(c1)CCCN2c3c(cno3)C#N
|
|
178
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
179
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
180
|
CCC(=O)OC1=C[C@@H]2[C@@H](C=C1)N(C(=C2C(=O)OCC)C)C
|
|
181
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
182
|
CCOC(=O)N=[S@@](=O)(c1ccccc1)N
|
|
183
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
184
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
185
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
186
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
187
|
C/C(=C/C1CCCCC1)/CCC2=N[C@@H](CO2)C(=O)OC
|
|
188
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
189
|
c1ccc2c(c1)[nH]c(=O)c(n2)n3ccnc3
|
|
190
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
191
|
CCS(=O)(=O)c1ccc(s1)c2cccc(c2)c3cc[nH]n3
|
|
192
|
CCOC(=O)/C=C/1CCC=C1N2CCOCC2
|
|
193
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
194
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
195
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
196
|
C1Cn2c(=O)[nH]c(=O)nc2N1
|
|
197
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
198
|
CCOC(=O)c1cc2c3ccccc3oc2s1
|
|
199
|
Cc1c(c(no1)/C=C/c2ccc(cc2)F)N
|
|
200
|
CC(=O)N1CN=C2N(C1)c3ccccc3S2
|
|
201
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
202
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
203
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
204
|
CCOC(=O)C1=C(CN(C1)C(=O)OCC)OC
|
|
205
|
COc1ccc(cc1)c2cnnn2Cc3ccco3
|
|
206
|
[H]/N=c/n(c2c(s1)CCCC2)CC(=O)c3ccccc3
|
|
207
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
208
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
209
|
c1cc(cnc1)c2cc3c(ncnc3o2)NC(=O)C4CC4
|
|
210
|
c1c2c(n[nH]1)[C@H]3[C@@H]([C@@H](C2=O)CC3=O)NCCC#N
|
|
211
|
CC1(C[C@@H](c2n1ccc2)Nc3ccc(cc3)OC)C
|
|
212
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
213
|
c1ccc(cc1)NCC(=O)[O-]
|
|
214
|
Cc1c(c-2c(cn1)CCc3c2cccc3)C#N
|
|
215
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
216
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
217
|
c1ccc(cc1)c2nc(cs2)c3ccn[nH]3
|
|
218
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
219
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
220
|
Cc1ccc(cn1)CC(=O)OCc2ncc(n2C)Cl
|
|
221
|
C=CCc1cc2nccn2cn1
|
|
222
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
223
|
CC1CCCC(N1)C2[N-]NNN2
|
|
224
|
Cc1nnc(n1C)COC(=O)c2cc(c(cc2Cl)Cl)F
|
|
225
|
c1ccc(cc1)S[C@@H]2c3ccccc3C(=O)O2
|
|
226
|
|
|
227
|
Cc1cc(ncn1)Nc2ccccc2
|
|
228
|
Cc1cc([nH]c(=O)c1C2=CC(=NCCN2)C(F)F)C
|
|
229
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
230
|
c1csc2c1c(ncn2)n3ccnc3
|
|
231
|
Cc1ccc(cc1)[C@@H](C/C=C
2c(cc(n2)C)C)O
|
|
232
|
CC(C)[C@@H]1[C@@H](N=C(O1)c2ccccc2)n3c4ccccc4nn3
|
|
233
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
234
|
CN(CCn1cccn1)c2ccccc2
|
|
235
|
CNC(=O)OCC#CCOC(=O)NC
|
|
236
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
237
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
238
|
CN1c2ccccc2Oc3c1cc(nn3)Cl
|
|
239
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
240
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
241
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
242
|
Cc1ccc(cc1)Nc2[nH+]c(=O)cc(s2)C
|
|
243
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
244
|
COc1ccc(cc1)c2nnc3n2NCS3
|
|
245
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
246
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
247
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
248
|
CC1=CC(=O)O[C@@H]1Cc2ccncc2
|
|
249
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
250
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
251
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
252
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
253
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
254
|
c1ccc(cc1)/C=C/CN2CCC(CC2)C#N
|
|
255
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
256
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
257
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
258
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
259
|
COCCSc1nnc(o1)c2c[nH]c3c2cccc3
|
|
260
|
C1C=C2C(=C[C@@]1(CCO)N)OCO2
|
|
261
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
262
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
263
|
Cc1ccc(cc1)OS(=O)(=O)c2cc(n(c2)C)C(=O)N
|
|
264
|
Cc1nnc(s1)Sc2c(n(c(=O)[nH]c2=O)C)N
|
|
265
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
266
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
267
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
268
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
269
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
270
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
271
|
c1c2c(n[nH]c1=O)CCCC2
|
|
272
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
273
|
CN(C)[C@@H](C/C=C/CC=C)C#N
|
|
274
|
CCS(=O)(=O)c1ccc(s1)c2cnn(c2)C
|
|
275
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
276
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
277
|
CCOC(=O)CCc1c2c([nH]c1C(=O)OCC)CNC(=O)C2
|
|
278
|
c1ccc2c(c1)CC[NH+]=C2c3ccco3
|
|
279
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
280
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
281
|
COc1ccc(cc1)c2csc3c2-n4cccc4C3=O
|
|
282
|
COC(=O)CCc1c[nH]cn1
|
|
283
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
284
|
c1cc(ccc1c2csc3[n+]2CCCCC3)Br
|
|
285
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
286
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
287
|
Cc1ccccc1SCCN2CCOC2=O
|
|
288
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
289
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
290
|
c1ccc2c(c1)cc([nH]2)c3nn4cnnc4s3
|
|
291
|
c1ccc(cc1)OCCn2ccnc2
|
|
292
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
293
|
CN(c1ccc(cc1)F)c2c(ccs2)n3cccc3
|
|
294
|
c1ccc(cc1)[C@@H]2C(=N2)c3ccccc3
|
|
295
|
Cc1nc(cs1)/C=C/c2cccnc2
|
|
296
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
297
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
298
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
299
|
CCCc1nncn1NC(=O)OCC
|
|
300
|
|
|
301
|
c1ccc(cc1)S[C@@H]2CCc3c2cccc3
|
|
302
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
303
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
304
|
C1CCC2C(C1)C3=NC4CCNCC4CN3C2=O
|
|
305
|
CC1CCN(CC1)c2ncc3c(n2)-c4cn(nc4NCC3)C
|
|
306
|
c1cc(cnc1)c2cccs2
|
|
307
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
308
|
Cc1c2c(nc(n1)C)Oc3ccc4ccccc4c3C2
|
|
309
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
310
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
311
|
c1ccc(cc1)N2C3=CCCC[C@H]3C(=O)C2=O
|
|
312
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
313
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
314
|
CC(=O)c1c(c2ccccc2o1)n3cccc3
|
|
315
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
316
|
Cc1c(sc(n1)c2c(cnc(n2)NCC=C)c3ccsc3)C
|
|
317
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
318
|
CC1=N/C(=C(/C)c2ccc(cc2)Cl)/C(=O)O1
|
|
319
|
CCOc1cc(c(o1)C)c2ccccc2
|
|
320
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
321
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
322
|
c1ccc2c(c1)c(c[nH]2)c3nn4cnnc4s3
|
|
323
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
324
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
325
|
c1cc(oc1)c2nc([nH]n2)N
|
|
326
|
C1CC2C(CC1BR)C3CCNC(C3[NH]2)C4=NCCC4
|
|
327
|
c1ccc(cc1)[C@@H]2C=C(OC(=N2)N)c3ccccc3
|
|
328
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
329
|
Cc1cc2n(c(c(s2)C(=O)C)[O-])c(=[NH2+])n1
|
|
330
|
COc1ccc(cc1OC)[C@@H]2CC[C@@H](O2)Cc3cccnc3
|
|
331
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
332
|
Cc1ccc(cc1)/C=C/2C(=O)C(=C(N2)C)C(=O)OC
|
|
333
|
c1cc(cnc1)NCc2csnn2
|
|
334
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
335
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
336
|
COC1=C2CCCC(=C2OC1=O)C3CCCCC3
|
|
337
|
c1cc(ccc1CC/C=C
2ccnc2)Cl
|
|
338
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
339
|
CCOC(=O)[C@@H]1CCC(=N1)c2ccc[nH]2
|
|
340
|
Cc1cccc(n1)n2cc(c(nc2=O)[O-])C#N
|
|
341
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
342
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
343
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
344
|
c1c[nH]nc1c2nccs2
|
|
345
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
346
|
c1ccc2c(c1)ccc(c2Cn3c4c(nn3)CC=CC4)O
|
|
347
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
348
|
c1ccc2c(c1)nc(c3n2ccc3)n4cccc4
|
|
349
|
CC1C(C2CC(CCN2N1)OC(=O)C)BR
|
|
350
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
351
|
Cc1nnc(o1)c2ccc(c(c2)N)O
|
|
352
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
353
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
354
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
355
|
c1c(cn[nH]c1=O)N2CCCC2
|
|
356
|
c1ccc2c(c1)CC(=C2)n3ccnc3
|
|
357
|
c1ccc(cc1)CC2=CC(=O)[C@H](C=N2)[O-]
|
|
358
|
c1cc(cc(c1)N)C2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
359
|
Cc1c(c([nH]n1)N)[C@@](c2nccn2C)(C(F)(F)F)O
|
|
360
|
c1ccc(cc1)S(=O)(=O)[N-]c2cccnc2
|
|
361
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
362
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
363
|
c1ccc2c(c1)CCN2Cn3c4ccccc4nn3
|
|
364
|
COc1ccc(cc1)/N=C/Cc2nc(c(s2)C#N)C(F)(F)F
|
|
365
|
Cc1nnc(o1)C(=O)Nc2ccccc2
|
|
366
|
C[C@H]1CN2c3ccccc3C([C@]2(N=C1O)C)(C)C
|
|
367
|
CC1=CC(=O)O[C@@]1(CC(=O)C2CCCCC2)O
|
|
368
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
369
|
CC(=O)NCCc1coc2c1ccnc2
|
|
370
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
371
|
CCC1NNC(S1)C2C3CCCCC3SN2
|
|
372
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
373
|
Cc1cc2c(c(=O)o1)S/C(=C(/C(=O)OC)C(F)(F)F)/O2
|
|
374
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
375
|
CC1NCC(N1CC2CCCCC2)[C@@H](C3CCCO3)O
|
|
376
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
377
|
CCCO[C@@H]1CCCN(C1)C(=O)c2ccnnc2
|
|
378
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
379
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
380
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
381
|
Cc1cn(cn1)c2cccnc2
|
|
382
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
383
|
c1cnccc1[C@@H]2CCC=CC2
|
|
384
|
c1cc(sc1)[C@@H]2[C@@H](C(=NC(=O)N2)[O-])C#N
|
|
385
|
Cc1cc(c(c(c1)O)c2c(c[nH]n2)c3nc(cs3)C)O
|
|
386
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
387
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
388
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
389
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
390
|
C1CCC2C(C1)OC(=O)NS(=O)(=O)O2
|
|
391
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
392
|
Cc1cc(n(n1)c2c(c([nH]n2)C)N)C
|
|
393
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
394
|
C[C@@]1(C(=O)C2CCCN2-C3CCCCC3O1)C4CCCCC4
|
|
395
|
c1cc2c(cc1Cn3cnnc3)OCO2
|
|
396
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
397
|
COc1ccccc1n2ccnc(c2=O)N
|
|
398
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
399
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
400
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
401
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
402
|
COC(=O)N1CCc2c(s[nH]c2=O)C1
|
|
403
|
c1ccc2c(c1)CCN2c3ccc(s3)C(=O)[O-]
|
|
404
|
c1cc(c(cc1S(=O)(=O)[O-])C(=O)[O-])c2cn[nH]c2[O-]
|
|
405
|
CCc1nc(c2n1c(ccc2)C)N3CCCC3=O
|
|
406
|
c1cc(sc1)c2cncnc2
|
|
407
|
c1cc(ccc1N2C3=CCCCC3=C(C2=O)O)Cl
|
|
408
|
Cn1ccc(n1)C#CCN2CCOCC2
|
|
409
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
410
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
411
|
Cc1ccccc1n2n(o2)c3ccccc3C
|
|
412
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
413
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
414
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
415
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
416
|
c1cc2c3c(c(ncn3)n4cccn4)sc2nc1
|
|
417
|
CC(=O)Nc1cc(n[nH]1)c2ccc(cc2)F
|
|
418
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
419
|
c1ccc(cc1)c2ccncn2
|
|
420
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
421
|
CC1CCC(CC1)[C@@H]2C(=N2)C(=O)OC
|
|
422
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
423
|
CC(=O)O[C@@H]1C=Cc2ccc3c4c2c1ccc4CC=C3OC(=O)C
|
|
424
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
425
|
Cc1cc2c(cn1)C(=O)OCC2
|
|
426
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
427
|
CCOC(=O)Cn1c(noc1=O)Cc2ccccc2
|
|
428
|
CC1C(C(N[NH]1)C2CCON2)N
|
|
429
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
430
|
CCOC(=O)c1c(=O)c2c(n3c1[NH2+]CC3)CCC2
|
|
431
|
c1cc(oc1)CSc2ccc(cc2)n3cnnn3
|
|
432
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
433
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
434
|
CCOC(=O)c1c(n(c2c1-c3c(non3)CC2)OC)C
|
|
435
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
436
|
Cc1c(sc2c1-c3c(cnc(n3)SC)S(=O)(=O)N2C)C
|
|
437
|
c1ccn(c1)C2CCN(CC2)CCC#N
|
|
438
|
c1ccc(cc1)CNc2ncco2
|
|
439
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
440
|
CC(=O)OC1CCC(C2C1CC=CC=C2)OC(=O)C
|
|
441
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
442
|
Cc1cc(n2c(n1)ncn2)n3ccnc3
|
|
443
|
CC(=CC[C@@H]1[C@@H](CCC1=O)c2cc(on2)Cc3ccccc3)C
|
|
444
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
445
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
446
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
447
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
448
|
CS(=O)(=O)N[C@@H]1CC(=O)N(C1)c2ccccc2
|
|
449
|
Cn1cncc1COC(=O)c2ccc(cc2)Cl
|
|
450
|
Cn1c2c(cn1)nc([nH]2)c3ccccc3
|
|
451
|
C1CCC(CC1)CON2CCCC2C#N
|
|
452
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
453
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
454
|
CCCOn1c(nnn1)c2ccccc2
|
|
455
|
c1ccc2c(c1)SC(=Cc3ccco3)S2
|
|
456
|
Cc1c2nc3ccccc3n2c(=O)[nH]n1
|
|
457
|
c1ccc(cc1)NC(=O)n2ccnc2
|
|
458
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2C=CC=C3)C#N
|
|
459
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
460
|
CC(=O)N[C@@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
461
|
c1ccc(cc1)c2cc(c(o2)n3cccc3)C#N
|
|
462
|
|
|
463
|
Cc1cc(n2c(n1)nnn2)c3ccccc3
|
|
464
|
c1ccc2c(c1)c3c(cc(s3)C(=O)[O-])c(=O)o2
|
|
465
|
CCS(=O)(=O)c1ccc(c(c1)n2c(c[nH]c2=O)O)OC
|
|
466
|
Cn1ccc(n1)C(=O)n2cccn2
|
|
467
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
468
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
469
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
470
|
CSc1nc(c(nn1)c2ccco2)c3ccco3
|
|
471
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
472
|
C=Cn1ccnc1CCOC(=O)c2ccc(cc2)Cl
|
|
473
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
474
|
Cc1ccc(cc1)n2c(nnn2)c3cn[nH]c3c4ccccc4F
|
|
475
|
|
|
476
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
477
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
478
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
479
|
c1cc(oc1)c2cc(no2)CO
|
|
480
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
481
|
CC(C)[C@H]1C(=N[C@@H](C(=N1)OC)Cc2cc(ccc2F)F)OC
|
|
482
|
CCCSc1ncc(cn1)CN2CCCn3c(cc(n3)C#N)C2
|
|
483
|
Cc1csc(n1)c2cn[nH]c2N
|
|
484
|
CCCCC#C/C=C/COC(=O)C
|
|
485
|
c1c2c(n[nH]c1=O)CCOC2
|
|
486
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
487
|
CN1CCC=C1c2cccnc2
|
|
488
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
489
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
490
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
491
|
CC1=C[C@@]2([C@@H](N=C1)N(C(=O)O2)C3CCCCC3)C
|
|
492
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
493
|
C1CC(CC(C1)BR)C2CN3CNSC3N2
|
|
494
|
C1CCCC(C1)C(=C/C2=C/C3CCNCC3)[C@@H](C4CCNCC4)O
|
|
495
|
c1ccc(cc1)C#CCNc2[n-]nnn2
|
|
496
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
497
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
498
|
CNC(=O)N(c1ccc(cc1)OC)C2=NCCOC2
|
|
499
|
Cn1c(=O)c(nn(c1=O)c2ccc(cc2F)F)c3ccn[nH]3
|
|
500
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
501
|
|
|
502
|
C[C@@H](C(=O)C1=N[C@@H]2C(=[NH+]C1)NC(=NC2=O)[NH-])[O-]
|
|
503
|
c1ccc(cc1)C(=O)c2ncco2
|
|
504
|
c1ccc(cc1)/C=C/c2nnc(o2)N
|
|
505
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
506
|
c1c[nH]nc1C2CCCCC2
|
|
507
|
|
|
508
|
c1cc2c(nc3ccsc3n2c1)N4CCC=CC4
|
|
509
|
c1cc2c(cc1c3ccc(s3)C(=O)N)NCCO2
|
|
510
|
c1cnccc1n2cc(cn2)N
|
|
511
|
c1nncn1N2C3=CCCCC3=C(C2=O)O
|
|
512
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
513
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
514
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
515
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
516
|
c1ccc(cc1)OC2=CC(=O)OC23CCCCC3
|
|
517
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
518
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
519
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
520
|
CC(C)c1nnc(o1)c2cc3c(nn(c3s2)C)C(F)(F)F
|
|
521
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
522
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
523
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
524
|
CC(=O)c1ccc-2c(c1)-c3c2cccc3
|
|
525
|
Cc1nc(cs1)c2cc(no2)CO
|
|
526
|
|
|
527
|
CNC1C2C(C3CCCCC3S2)NNN1
|
|
528
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
529
|
c1ccn2c(c1)nc3c2cc(s3)C(=O)[O-]
|
|
530
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
531
|
CC1(C=C(Oc2ccccc2O1)S(=O)(=O)c3ccccc3)C
|
|
532
|
c1ccc(cc1)c2c(=O)c3c(n4c2OCC4)CCC3
|
|
533
|
c1ccc2c(c1)N(CCS2)c3ccc(s3)C(=O)[O-]
|
|
534
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
535
|
c1ccc(cc1)c2cnc3n2nccc3
|
|
536
|
CCOC1=CC(=O)N(C1)c2ccc(cc2)C
|
|
537
|
Cc1c(n(ccc1=O)CCc2c[nH]cn2)C
|
|
538
|
[H]/N=c/nc(ss1)SCc2ccc(cc2)C(=O)OC
|
|
539
|
c1ccc(cc1)[C@@H]2C=C(n3c(ncn3)N2)c4ccccc4
|
|
540
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
541
|
CCOc1/c(=N/Cc2ccccc2)/c(=O)c1[O-]
|
|
542
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
543
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
544
|
Cc1ccc(=O)n(c1)C(=O)c2cc(cc(n2)c3ccccc3)OC
|
|
545
|
CN(c1ccccc1)c2ccc(s2)OC
|
|
546
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
547
|
C1CCC(CC1)/C=C/2CC-3OC(=O)C4C3C(C2=O)CCC4
|
|
548
|
CCc1cccc([o+]1)c2ccccc2
|
|
549
|
CC1=CC(=O)O[C@@H]2[C@@H]1C(=O)N(c3c2cccc3)C
|
|
550
|
|
|
551
|
CCn1cc(cn1)c2cc[nH]n2
|
|
552
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
553
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
554
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
555
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
556
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
557
|
|
|
558
|
C1CCC(C(C1)C2=C/C(=C/3C=CC=CC3=O)/C=NN2)O
|
|
559
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
560
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
561
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
562
|
CCc1c2c(n(n1)C3CCCC3)-c4nnc(n4CC2)C
|
|
563
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
564
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
565
|
c1ccc(cc1)c2nc(on2)c3csnn3
|
|
566
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
567
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
568
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
569
|
Cc1c2c(c(oc2ncn1)c3ccco3)c4ccco4
|
|
570
|
Cn1cc(cn1)NC(=O)c2cncn2c3ccccc3
|
|
571
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
572
|
Cc1nc2cc([nH]c2c(n1)N3CCC=CC3)c4ccccc4
|
|
573
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
574
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
575
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
576
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
577
|
CC(=O)O/C=C/c1ccccc1
|
|
578
|
CC(=O)c1cc2cnccc2[nH]c1=O
|
|
579
|
CCOC(=O)C1C(C-2C(N1C)CCC3C2NC(S3)N)C
|
|
580
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
581
|
c1ccc2c(c1)-c3c(cc(s3)C(=O)[O-])CS2
|
|
582
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
583
|
c1ccc(cc1)n2c3c(nc2Cl)CCC3
|
|
584
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
585
|
CN(C)C(=O)c1coc2c1nc3ccccc3n2
|
|
586
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
587
|
c1ccc(cc1)[C@@]2(C=C(C(=O)O2)O)O
|
|
588
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
589
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
590
|
C[C@@H]1c2nc3ccccc3n2CN(CO1)c4ccc(cc4)F
|
|
591
|
c1ccc(cc1)n2ccc(=O)cc2
|
|
592
|
CC(=O)NCC1CNCCN1
|
|
593
|
CC1(Cc2ccccc2-c3n1nnn3)C
|
|
594
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
595
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
596
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
597
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
598
|
c1ccc(cc1)C2=C(C(=O)N3[C@@H]2CCC3)O
|
|
599
|
CC1(Cc2ccccc2/C(=C/C(=O)N)/C1)C
|
|
600
|
Cc1c2ccccc2[nH]c(=O)c1Sc3nnnn3C
|
|
601
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
602
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
603
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
604
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
605
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
606
|
c1ccc(cc1)S(=NC(=O)c2ccco2)c3ccccc3
|
|
607
|
c1cc(cc(c1)F)[N-]S(=O)(=O)c2cc(oc2)C(=O)N
|
|
608
|
CNC(=O)Oc1ccccc1
|
|
609
|
Cc1cnc(o1)COc2ccccc2
|
|
610
|
c1ccc(cc1)c2c3c(c(c(c2C#N)N)C#N)CCC3
|
|
611
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
612
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
613
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
614
|
Cc1cc(nc2c1c(nn2C)n3c(c(nn3)C#N)N)C
|
|
615
|
Cc1ccc(cc1)S(=O)(=O)Cn2cccc(c2=O)O
|
|
616
|
c1ccc(cc1)c2cncs2
|
|
617
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
618
|
Cn1c(=O)n2c(c(n2c1=O)c3ccccc3)c4ccccc4
|
|
619
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
620
|
c1ccc-2c(c1)CN[C@@H](c3n2ccc3)c4ccc(cc4)F
|
|
621
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
622
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
623
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
624
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
625
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
626
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
627
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
628
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
629
|
c1cc(ccc1C#N)C2=C[C@@H]3C=CSC3=N2
|
|
630
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
631
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
632
|
Cc1ccc2c(c1)C(=O)C[C@@H](O2)c3ncc(n3C)Cl
|
|
633
|
C1CCN(C1)c2c(nns2)CO
|
|
634
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
635
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
636
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
637
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
638
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
639
|
[H]/N=c/n2c(c(s1)c3ccccc3)NCC2
|
|
640
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
641
|
Cc1nc2c(c(n1)N3CCCC3)CN(CC2)C(=O)C
|
|
642
|
Cn1c2ccccc2c3c1c(=O)cc(o3)CO
|
|
643
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
644
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
645
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
646
|
Cc1cn2c3c1CCCCn3c(n2)CN4CCCc5c4cccc5
|
|
647
|
C1CCC(CC1)C2=CC(=C(C2)C(=O)[O-])C3CCCCC3
|
|
648
|
CCCCC#CC#CCN(C)C
|
|
649
|
Cc1c(non1)c2cc3ccccn3c2
|
|
650
|
CCc1ccc(cc1)N2C(=O)CC(=O)N=C2O
|
|
651
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
652
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
653
|
c1ccc(cc1)Nc2nc(nc3n2ncc3C#N)Nc4cccnc4
|
|
654
|
COC(=O)[C@@H]1c2c(oc3cc(cc(c3c2=O)O)CO)C=C[C@@H]1O
|
|
655
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
656
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
657
|
Cc1c(con1)c2ccccc2
|
|
658
|
CCn1c2ccccc2n3c1nnc3c4cc(nn4C)C
|
|
659
|
COc1ccccc1C/C=C/c2cccs2
|
|
660
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
661
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
662
|
CC1=C(C(=O)OC1(C)C)c2[n-]nnn2
|
|
663
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
664
|
CCOC(=O)C1C(C2C(S1)N(C(=O)S2)C3CCCCC3)[O-]
|
|
665
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
666
|
c1ccc(cc1)C2=CC[C@@](C=C2)(C#N)F
|
|
667
|
|
|
668
|
c1cc2c(c(c1)S(=O)(=O)N)non2
|
|
669
|
CC1=CC(=O)O[C@@H](C1)c2ccccc2
|
|
670
|
CNC(=O)OCC(F)(F)F
|
|
671
|
CC(=O)Nc1c(c2c(s1)CN(CC2)C(=O)C)C#N
|
|
672
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
673
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
674
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
675
|
Cc1nc(cs1)c2ccnc(n2)N
|
|
676
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
677
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
678
|
COc1c(cc2c-3c1COc4c3c(cc(c4)O)CC2)O
|
|
679
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
680
|
c1ccc(cc1)C2=CC[C@@](C=C2)(O)Br
|
|
681
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
682
|
c1ccc(cc1)n2cc3cnnc(c3n2)[O-]
|
|
683
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
684
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
685
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
686
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
687
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
688
|
Cn1c(nnn1)Sc2cccc(c2C#N)F
|
|
689
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
690
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
691
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
692
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
693
|
c1c(c(sc1Cl)Cl)C2=NCCNC2=O
|
|
694
|
CCOc1c(nc(o1)C#N)C
|
|
695
|
Cc1cc2c(o1)cc(nc2Nc3cccc(c3)Cl)C(=O)OC
|
|
696
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
697
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
698
|
C=CC[C@@H]1CC=C[C@H](N1C(=O)c2[nH]ccn2)c3ccccc3
|
|
699
|
c1ccc2c(c1)[nH]c(=O)n2c3csc(n3)c4ccncc4
|
|
700
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
701
|
Cc1cc2n(c3ccccc3n2c1)C
|
|
702
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
703
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
704
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
705
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
706
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
707
|
Cc1ccc(nc1C)c2ccoc2
|
|
708
|
CCOC1CNNN1C2CCN(CC2)C(=O)OCC
|
|
709
|
Cc1cc2c(c(=O)o1)[C@@H](Sc3ccccc3N2)c4ccco4
|
|
710
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
711
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
712
|
c1ccc(cc1)c2cnc3n2CCOC3
|
|
713
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
714
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
715
|
CN1CCc2c1cc(c3c2N(CC3)C)c4ccco4
|
|
716
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
717
|
c1csc2c1c(n[nH]c2=O)N
|
|
718
|
CC1=C[C@@H](OC(=C1)C)c2ccccc2
|
|
719
|
c1ccc(cc1)C(=O)N2CCC3=CC(=O)O[C@@H]3C2
|
|
720
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
721
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
722
|
CC(C)(C)OC(=O)N1CCC[C@H]1Cn2c(nnn2)NC3CC3
|
|
723
|
CC(=O)OC/C=C/c1cccnc1
|
|
724
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
725
|
CC1(Nc2c(c3c(s2)CCCC3)-c4n1nnn4)C
|
|
726
|
COC(=O)c1ncn(n1)CN2CCC[C@@H]2c3cccs3
|
|
727
|
CCCNC(=O)Nc1c(c(c(o1)C)C)C#N
|
|
728
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
729
|
c1ccc(cc1)N2CCNC2=O
|
|
730
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
731
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2c4ccccc4C=C3)C#N
|
|
732
|
CCCCc1ccc(cc1)On2ccc(=O)cc2
|
|
733
|
c1ccc(cc1)c2cnn3c2NC(=O)[C@@H](C3)CC(=O)[O-]
|
|
734
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
735
|
Cc1c(cn(n1)C)c2nnc(s2)NC
|
|
736
|
CCNC(=O)n1cc(c(n1)c2ccccc2)c3ccncn3
|
|
737
|
c1cnoc1c2nnc(o2)N
|
|
738
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
739
|
c1csc2c1ncnc2n3ccnc3
|
|
740
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
741
|
c1ccc(cc1)c2cnns2
|
|
742
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
743
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
744
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
745
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
746
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
747
|
c1ccc(cc1)CCOn2ccnc2
|
|
748
|
CC(=O)N1CCC(=CC1)c2ccc(cc2)O
|
|
749
|
Cc1nnc(o1)CSc2ccccn2
|
|
750
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
751
|
COC(=O)c1c(c2c([nH]1)c3ccccc3n4c2nnn4)N
|
|
752
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
753
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
754
|
C1CC2C(CC1C3NNC(O3)N)SCN2
|
|
755
|
CCSc1nnc2n1CCN2c3ccccc3
|
|
756
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
757
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
758
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
759
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
760
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
761
|
|
|
762
|
CCCc1nc(c2n1nc([nH]c2=O)c3ccccc3OCC)C
|
|
763
|
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C=C1)O
|
|
764
|
CC1=NN=C2[C@H]1C(=c3ccccc3=[NH+]2)Oc4ccc(cc4)OC
|
|
765
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
766
|
CC1CC(C/C(=[NH+]/C2CCCCC2)/O1)O
|
|
767
|
c1ccc(cc1)c2c3ccccn3nn2
|
|
768
|
CCCCN1[C@@H](C(=C(C1=O)C)C)Nc2ccc(cc2)C#N
|
|
769
|
c1ccc(cc1)C2=N[C@@H]3N(C2)c4ccc(cc4S3)C(=O)[O-]
|
|
770
|
Cc1c(c(on1)N)Sc2ccc(cc2)Br
|
|
771
|
Cn1cccc1CCn2ccnc2
|
|
772
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
773
|
COc1c2ccoc2c(c(c1c3cc(n[nH]3)C(F)(F)F)O)OC
|
|
774
|
CCNC(=O)Oc1c2ccccc2on1
|
|
775
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
776
|
C=CCSc1nccn1c2ccccc2
|
|
777
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
778
|
COC(=O)Nc1cn2ccccc2n1
|
|
779
|
CSc1c(c(c(s1)c2cc[nH]n2)c3ccco3)C#N
|
|
780
|
c1cc(cnc1)c2nnc(s2)Cc3cccs3
|
|
781
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
782
|
Cn1cc(cn1)c2nnc(o2)SC
|
|
783
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
784
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
785
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
786
|
C[C@@H]1CSc2c1ncc(c2)C(=O)OC
|
|
787
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
788
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
789
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
790
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
791
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
792
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
793
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
794
|
CC1=N/C(=C/C=C(Oc3c2cccc3)c4cccs4)/C(=O)O1
|
|
795
|
COC(=O)C1=CNN2C1=NCN(C2)Cc3ccccc3
|
|
796
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
797
|
c1ccc2c(c1)OC(=Cc3ccco3)O2
|
|
798
|
Cc1ccc(cc1)n2cnnc2
|
|
799
|
|
|
800
|
CC1NC(ON1)[C@@H]2CCC=CC2
|
|
801
|
CCOc1c(c(=O)c1=O)/C=C/N(c3ccccc3S2)CC#C
|
|
802
|
c1coc2c1c(=O)[nH]nc2[O-]
|
|
803
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
804
|
Cc1ccc(cc1)n2ccnc2
|
|
805
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
806
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
807
|
C1CCC(CC1)NN2CNC3C2C4CCCCC4CC3
|
|
808
|
CC(C)c1nc([nH]n1)CC#N
|
|
809
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
810
|
COC(=O)c1c(cc(s1)c2cc(no2)c3ccccc3)N
|
|
811
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
812
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
813
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
814
|
Cc1cn2c(n1)Nc3c(c4c(s3)CCCC4)C2
|
|
815
|
CCOC(=O)c1c2cccc3c2n(c1c4ccccc4)CCS3
|
|
816
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
817
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
818
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
819
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
820
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
821
|
c1ccc(cc1)N[C@@H](c2ccco2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
822
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
823
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
824
|
|
|
825
|
c1ccc-2c(c1)CCc3c2nns3
|
|
826
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
827
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
828
|
c1cnn(c1)c2cncc(n2)Cl
|
|
829
|
CSC1NC2C(S1)NC(OC2=O)C3CCCCC3
|
|
830
|
Cc1nc2c(n1c3ccccc3)nc(s2)C
|
|
831
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
832
|
COc1cccc(n1)[C@H]2CCC(=O)NC2
|
|
833
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
834
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
835
|
CCOC(=O)c1nn(c2n1c(=O)cc(n2)N)c3ccccc3
|
|
836
|
Cn1cc(c(c1[C@@H]2CCCO2)C(=O)[O-])c3ccccc3
|
|
837
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
838
|
c1ccc(cc1)n2c(nnn2)Cn3c(nnn3)C4CCCC4
|
|
839
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
840
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
841
|
Cc1c2c(n(n1)c3ccc(cc3)F)Oc4ccccc4N=C2
|
|
842
|
Cc1cc(=O)sc2c1c(nn2c3ccccc3)C
|
|
843
|
c1ccc(cc1)C2=CC(=NC(=O)[C@@H]2C#N)c3ccccc3O
|
|
844
|
c1ccc(cc1)C2=NS(=O)(=O)Nc3c2cccc3
|
|
845
|
Cn1c(nc(n1)Br)n2ccnc2
|
|
846
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
847
|
c1cc(oc1)/C=C/2CCC(=O)O2
|
|
848
|
c1cc(cnc1)CNCCc2ccco2
|
|
849
|
c1cc(ccc1SCc2ccsc2c3ncns3)Cl
|
|
850
|
CCO[C@@H]1C=C(Oc2c1cccc2)c3ccc(cc3)F
|
|
851
|
CC(=O)Nc1ccc(o1)C(=O)[O-]
|
|
852
|
CN1NC(NN1)C2[N-]NNN2
|
|
853
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
854
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
855
|
CC(=O)N(C)c1cccnc1
|
|
856
|
CC(=O)N1CCC(=CC1)c2c[nH]c3c2cccn3
|
|
857
|
c1ccc(cc1)c2ccc(n2Cc3cccc(n3)N)c4ccccc4
|
|
858
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
859
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
860
|
CN(CCc1ccccn1)c2nc(=[N+](C)C)ss2
|
|
861
|
CN(CC#CCN(C)C1=NC(=O)CC1)C2=NC(=O)CC2
|
|
862
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
863
|
c1cc2c(c(c1)F)c(nc3n2nnc3C#N)N
|
|
864
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
865
|
c1ccc(cc1)c2nccnn2
|
|
866
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
867
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
868
|
Cc1nnc(n1c2ccc(cc2)OC)Sc3ccccn3
|
|
869
|
c1ccc2c(c1)N(CCO2)c3ccc(s3)C(=O)[O-]
|
|
870
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
871
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
872
|
c1ccc(cc1)C(=O)[C@H](C#N)C2=NCCC2
|
|
873
|
|
|
874
|
c1cc2c(cc1C#N)CCCC=C2
|
|
875
|
Cc1c2c(on1)C=C(CC2)c3ccccc3
|
|
876
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
877
|
Cc1nc(cn1C(=O)C)NC(=O)C
|
|
878
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
879
|
Cn1c(ccn1)/C=C/c2ncc(s2)C(=O)OC
|
|
880
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
881
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
882
|
c1ccc(cc1)C(=O)c2ccc(=O)oc2
|
|
883
|
c1ccc2c(c1)c(=O)c3=c(c2=O)sc(c(s3)C#N)C#N
|
|
884
|
c1cc(oc1)[C@@H]2Nn3c(nnc3S2)c4ccc(cc4)O
|
|
885
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
886
|
c1ccc(cc1)c2nc(nc(n2)n3cccc3)N
|
|
887
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
888
|
CC1=NN2c3ccccc3NC2=NC(=O)C1
|
|
889
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
890
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
891
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
892
|
c1cc(ccc1F)SN2CCOCC2
|
|
893
|
c1ccc(cc1)COn2ccnc2
|
|
894
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
895
|
CCn1c(=O)n-2c(n1)COc3c2cc(cc3)Cl
|
|
896
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
897
|
CC1(C=C(c2c1ccc(c2)C#N)n3ccccc3=O)C
|
|
898
|
CC(C)(C)c1nc(on1)Cn2cnc(n2)C#N
|
|
899
|
COc1ccc(cc1)C2=NCSc3n2ncn3
|
|
900
|
c1ccc(cc1)CSc2ccsc2
|
|
901
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
902
|
Cc1c(ccc2c1oc(=O)c3c2oc(n3)C)OC(=O)C
|
|
903
|
CCOc1ccc2c(c1)cc(c3n2c(=O)n(n3)C)C4OCCO4
|
|
904
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
905
|
c1cnsc1C(=O)N2CC(C2)F
|
|
906
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
907
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
908
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
909
|
Cc1cn(nn1)c2ccccc2
|
|
910
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
911
|
CC1=C[C@@H](c2c(=O)c(c(oc2S1)N)C#N)c3ccoc3
|
|
912
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
913
|
c1ccc(cc1)[N-]S(=O)(=O)CC2=NC(=O)n3cccc3C2=O
|
|
914
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
915
|
c1ccc2c(c1)[C@@H]3C4=C(CCCC4)C(=C3NC2=O)C(=O)N
|
|
916
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
917
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
918
|
c1c([nH]nn1)SCC(=O)N
|
|
919
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
920
|
Cc1ccc(c(=O)[nH]1)C(=O)O/C2=CC3=NC=CC3
|
|
921
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
922
|
|
|
923
|
CC1(COC(=N1)CCCOc2ccc(cc2Cl)Cl)C
|
|
924
|
c1ccc-2c(c1)CNc3c2cccc3
|
|
925
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
926
|
c1ccc2c(c1)Nc3c(cc(nn3)Cl)S2
|
|
927
|
Cc1cc2c(c(n1)C)c(=O)[nH]n2C(=O)C
|
|
928
|
c1cc(ccc1N2CCC(=C2[O-])C(=O)/N=c/3[nH]ccs3)F
|
|
929
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
930
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
931
|
C/C=C/c1c2c(on1)C[C@@H](OC2=O)C
|
|
932
|
c1cc2c(cc1F)C(=O)NC2
|
|
933
|
CCOC(=O)c1c-2c(c(=O)oc1N)C(=O)c3c2cccc3
|
|
934
|
CCOc1ccc(cc1)N2C(=O)CN=C3C2=NCCC3
|
|
935
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
936
|
c1ccc2c(c1)CCC3=C2CCC(=O)N3
|
|
937
|
CCCNC(=O)c1c(sc2c1oc(c2)c3ccccc3)C
|
|
938
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
939
|
c1cnccc1CSc2nncs2
|
|
940
|
C1CCC(CC1)[C@@H]2C[C@@H]2NC3=NCCO3
|
|
941
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
942
|
Cc1cc-2c(s1)CCCCc3n2nnn3
|
|
943
|
Cc1c(c(nn1C)n2cnnc2)NS(=O)(=O)c3c[nH]cn3
|
|
944
|
Cc1cc([nH]c(=O)c1C2=NCCNC(=C2)C(F)(F)F)C
|
|
945
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
946
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
947
|
COCCC/N=C/[C@@H](C(=O)C1=O)NCCO
|
|
948
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
949
|
CCOC(=O)C1=CN/C(=C(/O)OCC)/C1=O
|
|
950
|
c1cn(cn1)C(=O)n2ccnc2
|
|
951
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
952
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
953
|
Cc1c2c(nc(oc2=O)c3ccccc3Cl)on1
|
|
954
|
c1cnn(c1)Cc2nnc3n2CCC3
|
|
955
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
956
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
957
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
958
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
959
|
c1ccc2c(c1)-c3c4c(cccc4[nH]n3)C2=O
|
|
960
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
961
|
c1cc(cnc1)c2nc3cnccc3nn2
|
|
962
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
963
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
964
|
CCCN(C)c1ccc2c3c(cn2n1)c(nn(c3=O)C)Cl
|
|
965
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
966
|
CCOC(=O)Nc1c(n[nH]n1)Cl
|
|
967
|
CCn1cc(cn1)c2cncn2CCCC(C)(C)CO
|
|
968
|
Cc1ccc(cc1)N2CCCOC2=O
|
|
969
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
970
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
971
|
c1ccc2c(c1)CC(C2)(C#N)O[C@@H]3CCCCO3
|
|
972
|
Cc1cccc(n1)n2ccnc2
|
|
973
|
c1ccc2c(c1)C[C@@H]3C(=O)N=C(N3C2)Nc4ccccc4F
|
|
974
|
c1ccc(cc1)n2c(=O)cc3n(c2=O)CCN3
|
|
975
|
c1cc(ccc1c2c3ccoc3ccn2)C(=O)N
|
|
976
|
Cc1ccc2c(c1)C=Cc3ccccc3O2
|
|
977
|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
|
|
978
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
979
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
980
|
|
|
981
|
c1ccc(cc1)C=N2=CC=CC=C2
|
|
982
|
Cc1ccc(s1)Nc2ccccc2
|
|
983
|
COC1=NC[C@@H](CC1)C(F)(F)F
|
|
984
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
985
|
Cc1ccc(n1c2ccc3c(c2)nns3)C
|
|
986
|
c1cc(sc1)CCNc2ncccn2
|
|
987
|
CC1=NN=C2C1=CC(=C[C@H](C2=O)BR)BR
|
|
988
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
989
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
990
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
991
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
992
|
CCOc1c2c(cc([nH]2)C(=O)OCC)nc(n1)OCC
|
|
993
|
c1ccc(c(c1)C(=O)O[C@@H]2Cn3c(nnn3)SC2)Cl
|
|
994
|
CCN1C[C@@H](CC1=O)NC(=O)Cc2c(non2)C
|
|
995
|
CC1C2C(NNC1NC(=O)C)C[C@@H](C2)C(=C)C
|
|
996
|
C1CCC2(CC1)CNC(=O)O2
|
|
997
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
998
|
Cc1ccc(cc1)c2cc(=O)cc(s2)Cl
|
|
999
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
1000
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
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