(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
2
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
3
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
4
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
5
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
6
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
7
|
c1csc2c1n3cn[nH]c(=O)c3c2
|
|
8
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
9
|
c1c([nH]nn1)SCC(=O)N
|
|
10
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
11
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
12
|
|
|
13
|
CCn1c2c(con2)c(=O)[nH]c1=O
|
|
14
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
15
|
Cn1c(=O)[nH]c(=O)n(c1=O)C
|
|
16
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
17
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
18
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
19
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
20
|
|
|
21
|
c1ccc(cc1)c2cnccn2
|
|
22
|
c1cnccc1c2cc3c([nH]2)CNC3=O
|
|
23
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
24
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
25
|
c1csc2n1c(=O)[nH]c(=O)n2
|
|
26
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
27
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
28
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
29
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
30
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
31
|
c1cn[nH]c1NC(=O)CC#N
|
|
32
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
33
|
C[C@@H]1CCC2C(C(=O)[NH]C(N2)N)N1
|
|
34
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
35
|
c1c[nH]nc1C(=O)NC2CC2
|
|
36
|
c1cc(cc(c1)N)c2cocn2
|
|
37
|
c1c2c(c(=O)[nH]n1)Sc3cn[nH]c(=O)c3S2
|
|
38
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
39
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
40
|
C[C@@]12CC(=N[C@@H]1NC(=O)C2)c3ccccc3O
|
|
41
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
42
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
43
|
CCc1nc(c(o1)C(=O)NCCSc2[nH]ncn2)C
|
|
44
|
c1c2c(=O)[nH]c(nc2n[nH]1)[O-]
|
|
45
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
46
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
47
|
|
|
48
|
Cn1c(c(c(=O)[nH]c1=O)Oc2ccc(cc2Cl)F)N
|
|
49
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
50
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
51
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
52
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
53
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
54
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
55
|
C1CNNCC1CCC(=O)[O-]
|
|
56
|
Cc1c(c(=O)[nH]c(n1)[O-])C#N
|
|
57
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
58
|
C[C@@H]1[C@@H](OCC(=O)N1)C2CCCCC2
|
|
59
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
60
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
61
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
62
|
CS(=O)(=O)Nc1[n-]cnn1
|
|
63
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
64
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
65
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
66
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
67
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
68
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
69
|
COc1cc[nH]c(=O)c1C#N
|
|
70
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
71
|
C[C@@H]1[C@@H](Nn2c(nnn2)N1)C
|
|
72
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
73
|
c1ccc2c(c1)nnn2S(=O)(=O)c3ccco3
|
|
74
|
CC1NNC2N1CC[NH]C2=O
|
|
75
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
76
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
77
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
78
|
c1c2cn[nH]c2cnc1Cl
|
|
79
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
80
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
81
|
CCCCCCC1CN[NH]N1
|
|
82
|
c1c(cnc2c1COC(=O)N2)Br
|
|
83
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
84
|
C1CCC2C(C1)OC(=O)NS(=O)(=O)O2
|
|
85
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
86
|
CCOC(=O)Nc1c(n[nH]n1)Cl
|
|
87
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
88
|
c1ccc(cc1)[C@@]2(C=C(C(=O)O2)O)O
|
|
89
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
90
|
C=CCOC1CCNC(N1)N
|
|
91
|
COc1c2c([nH]n1)nncn2
|
|
92
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
93
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
94
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
95
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
96
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
97
|
C1C(=O)CC2NN[NH]N2C1N
|
|
98
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
99
|
c1cc(sc1)c2c(non2)N
|
|
100
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
101
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
102
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
103
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
104
|
c1cc2c(ccc3c2nno3)c(c1)S(=O)(=O)[O-]
|
|
105
|
c1cc(sc1)c2ccn[nH]2
|
|
106
|
c1ccn(c1)c2c(non2)N
|
|
107
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
108
|
c1cc(oc1)c2ccnc(n2)N
|
|
109
|
CCC(=O)Nc1c(non1)N
|
|
110
|
|
|
111
|
c1ccc2c(c1)-n3c(n[nH]c3=O)CS2
|
|
112
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
113
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
114
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
115
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
116
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
117
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
118
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
119
|
Cn1c(=O)[nH]c(=O)c(n1)C#N
|
|
120
|
Cc1cc([nH]n1)OCCC#N
|
|
121
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
122
|
|
|
123
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
124
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
125
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
126
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
127
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
128
|
c1cc(sc1)C(=O)n2cnnc2N
|
|
129
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
130
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
131
|
CSc1nc(c(n1Cc2ccco2)C#N)N
|
|
132
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
133
|
c1ccc2c(c1)n3c(o2)[nH+]c(nc3=O)N
|
|
134
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
135
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
136
|
Cc1c(c(n[nH]1)O)[C@@H](c2ccco2)C(C#N)C#N
|
|
137
|
c1ccc2c(c1)CCc3c(cc(cc3O2)N)N
|
|
138
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
139
|
Cc1cc-2c(s1)CCCCc3n2nnn3
|
|
140
|
CCOC(=O)N1CCNC(=O)C1
|
|
141
|
COC(=O)CCc1c[nH]cn1
|
|
142
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
143
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
144
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
145
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
146
|
|
|
147
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
148
|
Cc1c(sc(c1c2ccno2)SC)C#N
|
|
149
|
Cc1c(c(on1)C)Cc2ccc(s2)C(=O)[O-]
|
|
150
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
151
|
CCOC(=O)[C@@H](CC#N)C#N
|
|
152
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
153
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
154
|
c1cnn2c1N[C@H](CC2=O)CO
|
|
155
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
156
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
157
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
158
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
159
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
160
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
161
|
|
|
162
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
163
|
CC1=Nn2c(nnc2N=C(C1)O)N
|
|
164
|
c1csc2c1NC(=O)CCC2
|
|
165
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
166
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
167
|
CC1([C@@H](C=NC(=O)N1)c2ccccc2)C
|
|
168
|
Cc1[nH]cc(n1)Br
|
|
169
|
CCCn1c(n[nH]c1=O)c2cccs2
|
|
170
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
171
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
172
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
173
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
174
|
c1c[nH]c(=O)c2c1scc2
|
|
175
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
176
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
177
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
178
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
179
|
c1nc2c(s1)c(=O)[nH][nH]c2=O
|
|
180
|
C[C@@H]1C2=C(COC2=O)NC(=O)N1
|
|
181
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
182
|
c1ccc2c(c1)c(co2)c3c([nH]c(=O)[nH]c3=O)[O-]
|
|
183
|
Cc1ccc(cc1)c2cnon2
|
|
184
|
c1ccc(cc1)Nc2nncs2
|
|
185
|
c1c(c[nH]c1C(=O)[O-])S(=O)(=O)N
|
|
186
|
C[C@@H]1C=Cc2cc(ccc2O1)O
|
|
187
|
c1ccc2c(c1)C[C@H]([C@@H]2O)O
|
|
188
|
Cc1csc(n1)c2cn[nH]c2N
|
|
189
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
190
|
Cn1c(c(nc1Sc2cccs2)C#N)C#N
|
|
191
|
Cn1cc(cn1)c2ccncn2
|
|
192
|
c1ccc(cc1)NCC(=O)[O-]
|
|
193
|
c1cnc2cc3c(cc2n1)[C@@H]4C[C@H]3C(=O)NC4
|
|
194
|
Cc1c(c(on1)C)Cn2ccccc2=O
|
|
195
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
196
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
197
|
c1c(snn1)c2csnn2
|
|
198
|
c1c2c(nc(n1)N)CCCC2=O
|
|
199
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
200
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
201
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
202
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
203
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
204
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
205
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
206
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
207
|
COc1cccc(n1)[C@H]2CCC(=O)NC2
|
|
208
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
209
|
c1ccc2c(c1)NS(=O)(=O)N2
|
|
210
|
Cc1c(c[nH]n1)c2ccccc2
|
|
211
|
c1ccc2c(c1)C(=O)OCC(=O)N2
|
|
212
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
213
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
214
|
Cn1cc(cn1)c2cnccn2
|
|
215
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
216
|
c1cn[nH]c1c2ccsc2
|
|
217
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
218
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
219
|
c1c(cn[nH]1)CS(=O)(=O)N
|
|
220
|
CC(=O)NCCc1coc2c1ccnc2
|
|
221
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
222
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
223
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
224
|
c1nncn1c2[n-]c(nn2)N
|
|
225
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
226
|
|
|
227
|
CC[C@H]1[C@H](C(=O)N1)NC(=O)OC
|
|
228
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
229
|
CC1(C(=O)N(C(=N1)O)CC(=O)[O-])C
|
|
230
|
c1cc2c(cc1N)c3c(o2)CCC3
|
|
231
|
c1cnoc1c2nnc(o2)N
|
|
232
|
CCOC(=O)c1[nH]nc(n1)N
|
|
233
|
[H]/N=c/c(cnc2n1ccs2)C#N
|
|
234
|
CC1C(C(N[NH]1)C2CCON2)N
|
|
235
|
c1cc2c(cc1F)-c3c(cno3)CS2
|
|
236
|
CCCN1CC(=C(C1=O)C#N)[O-]
|
|
237
|
c1cc2c(cc1N)COCO2
|
|
238
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
239
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
240
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
241
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
242
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
243
|
C1C(=O)N=C2C=CC=CN2C1=O
|
|
244
|
COC(=O)/C=c/c(=O)[nH]c(=C)s1
|
|
245
|
C1COC(=CO1)c2nnc(o2)N
|
|
246
|
COc1ccc2c(c1)C[C@@H]2O
|
|
247
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
248
|
c1cc(ccc1N)Oc2nccs2
|
|
249
|
c1cc2c(cc1N)SCN2
|
|
250
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
251
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
252
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
253
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
254
|
CC(C)(C)S(=O)(=O)c1cn[nH]c1N
|
|
255
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
256
|
C1CCc2c([nH]nc2O)CC1
|
|
257
|
c1cocc1c2nc([nH]n2)N
|
|
258
|
Cc1[nH]c(cn1)C(F)(F)F
|
|
259
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
260
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
261
|
c1cnn(c1)Cn2cc(cn2)N
|
|
262
|
Cc1cc(c(n1C)C)C(=O)COn2c3cc(ccc3nn2)Cl
|
|
263
|
|
|
264
|
c1c(cncn1)n2cc(nc2)N
|
|
265
|
Cc1c(cccc1Cl)C#N
|
|
266
|
Cn1cc(cn1)c2ccncc2
|
|
267
|
C(CF)NC(=O)NCCF
|
|
268
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
269
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
270
|
c1cc2c(nc1)[C@@H](O[C@@H]2O)O
|
|
271
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
272
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
273
|
c1nc(c(n1CCO)N)C#N
|
|
274
|
C1C=C2C(=CC(=O)O2)[C@@H](O1)O
|
|
275
|
c1ccc(cc1)c2cncnc2
|
|
276
|
c1cc(ncc1C#N)Sc2nccs2
|
|
277
|
CC(C)NC(=O)N[C@H]1COCCO1
|
|
278
|
c1cc2c(cc1S(=O)(=O)[O-])nc[nH]2
|
|
279
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
280
|
c1(c(sc(=O)s1)C(=O)N)C(=O)N
|
|
281
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
282
|
c1c[nH]c2c1c(cnc2)Cl
|
|
283
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
284
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
285
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
286
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
287
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
288
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
289
|
c1ccc(cc1)CNc2c(non2)O
|
|
290
|
c1coc2c1[nH]c(c2)C(=O)[O-]
|
|
291
|
C=c1/c(=C/c2ccccc2O)/c(=O)o[nH]1
|
|
292
|
|
|
293
|
c1cc(cnc1)[C@@]2(CCC=C2)O
|
|
294
|
C1CCC2(CC1)CNC(=O)O2
|
|
295
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
296
|
CC(=O)Oc1ccc(nn1)[O-]
|
|
297
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
298
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
299
|
CCc1cnnn1c2c(non2)N
|
|
300
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
301
|
C1CCC2C(C1)C(=CN=CO2)O
|
|
302
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
303
|
Cc1nc(on1)CNC(=O)C
|
|
304
|
c1cnoc1c2ccsc2
|
|
305
|
Cc1ccc(cc1)S(=O)(=O)c2csc(n2)C
|
|
306
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
307
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
308
|
Cn1c2c(c(=O)[nH]c1=O)non2
|
|
309
|
Cc1nc(on1)c2c(non2)N
|
|
310
|
|
|
311
|
c1[nH]c(c(n1)C(=O)[O-])C(=O)[O-]
|
|
312
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
313
|
CCCNC(=O)Cc1nc[nH]n1
|
|
314
|
c1cc2c(cc1N)NCC[NH2+]2
|
|
315
|
CCCCCS(=O)(=O)N
|
|
316
|
CCOc1c(c([nH]n1)N)C#N
|
|
317
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
318
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
319
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
320
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
321
|
c1cc2c(cc1F)C(=O)NC2
|
|
322
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
323
|
c1nnc(s1)NCCC#N
|
|
324
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
325
|
CC1=C([C@@H](C1)C(=O)N)C(=O)N
|
|
326
|
c1ccc(cc1)c2cc(no2)c3c(non3)N
|
|
327
|
c1cc(cc(c1)N)CC(=O)[O-]
|
|
328
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
329
|
c1cc(cnc1)[C@@H]2CC(=O)Nc3c2c4c(s3)CCCC4
|
|
330
|
c1cc2c(cc1N)c3c(c(=O)o2)NCCC3
|
|
331
|
C1COCCN1C2C(=O)NC(SN2)N
|
|
332
|
c1cc(ccc1C#N)C(=O)OCc2nccn2C(F)F
|
|
333
|
Cc1c(c2ccccc2o1)C#N
|
|
334
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
335
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
336
|
CCCCOC1=N[C@@H]2[C@@H](CNC2=O)CO1
|
|
337
|
c1nc(nn1CCC#N)N=N=N
|
|
338
|
CC1=C(OC2=NC(=O)C[C@@]12C#N)C
|
|
339
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
340
|
|
|
341
|
Cc1ccc(cc1)c2[n-]nnn2
|
|
342
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
343
|
C1[C@@H]2N(C1=O)[C@@H](/C(=C/CO)/O2)C(=O)[O-]
|
|
344
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
345
|
Cc1c(c(n[nH]1)C)Sc2ccccc2
|
|
346
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
347
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)[O-]
|
|
348
|
|
|
349
|
CCc1c(nc(n1C#N)CC)C
|
|
350
|
C1CNC(=O)[C@@H]2[C@H]1CNC2=O
|
|
351
|
CC1=Cc2c(ccc3c2non3)N(C1)C
|
|
352
|
C1CN2C(CN1)CNC2CL
|
|
353
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
354
|
CCn1c2c(c(n1)C)NC(=O)CNC2=O
|
|
355
|
CS(=O)(=O)N1CCNC1=O
|
|
356
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
357
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
358
|
c1csc(c1Cl)c2c[nH]c(c2C#N)N
|
|
359
|
COC(=O)/C=C/C(=O)NCCN1
|
|
360
|
Cc1csc(n1)c2c(non2)N
|
|
361
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
362
|
c1cnc(nc1c2nccs2)N
|
|
363
|
Cc1c(n2c(c1C#N)NCC2)C
|
|
364
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
365
|
c1ccc2c(c1)c(c(s2)NC(=O)O)C#N
|
|
366
|
c1nc2c(c(n1)[O-])nsc2C(=O)[O-]
|
|
367
|
C(C#N)c1nc(nc(n1)N)N
|
|
368
|
CC1=C(CCOC1)CC(=O)N
|
|
369
|
c1c2n(c(=O)[nH]c1=O)[C@@H]3[C@@H]([C@@H]([C@H]([C@@H]2CCO)O3)O)O
|
|
370
|
C1CCc2c(c3n(n2)CCNC3=O)C1
|
|
371
|
Cc1c2sc(n1)NC(=O)N2
|
|
372
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
373
|
CCCSc1c(nns1)C
|
|
374
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
375
|
C1CN[C@@](C(=O)N1)(C(F)(F)F)O
|
|
376
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
377
|
CC1CC(=O)C(C(S1)C)C#N
|
|
378
|
Cc1c(cno1)c2csc(n2)C
|
|
379
|
c1c(cc2c3c1occ3CC(=O)O2)O
|
|
380
|
c1ccc(cc1)[C@@H]2C(=O)Oc3cccnc3S2
|
|
381
|
C(#N)c1c(c(ns1)Cl)Cl
|
|
382
|
Cc1c(nc([nH]1)C=C)C(=O)C
|
|
383
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
384
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
385
|
c1c[nH]nc1C2CCCCC2
|
|
386
|
C1CCc2c(c3c(s2)C(=O)NCC3)C1
|
|
387
|
c1ccc(cc1)[C@H]2[C@H](C(=O)N2)O
|
|
388
|
C1COCCN1C(=O)CC#N
|
|
389
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
390
|
C1CCC(CC1)SC2[N-]NNN2
|
|
391
|
c1c[nH]c2c1ncc(n2)Cl
|
|
392
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
393
|
c1ccc2c(c1)c-3nncc3co2
|
|
394
|
Cc1c2c(n3c(n1)nnn3)CCC2
|
|
395
|
CCSc1ccc(nn1)N
|
|
396
|
c1ccc2c(c1)CNC(=O)CS2
|
|
397
|
C1CCO[C@@H](C1)CS(=O)(=O)N
|
|
398
|
CC(C)(C)OC(=O)N1CCC(CC1)Cc2cnc[nH]2
|
|
399
|
c1cc2c(c(c1)Cl)[nH]nn2
|
|
400
|
CC1=C(C(=O)OC1(C)C)c2[n-]nnn2
|
|
401
|
c1cc(sc1)c2ccncn2
|
|
402
|
c1ccc2c(c1)C(=O)NCCO2
|
|
403
|
C1C[C@@H](Cc2c1snn2)C(=O)[O-]
|
|
404
|
c1cnc(cn1)c2nnc(o2)N
|
|
405
|
CC1(COC(=O)[C@@H]1OC(=O)C#C)C
|
|
406
|
Cc1c(c(n(n1)C)Cl)C#N
|
|
407
|
C1CCC2(CC1)C3=C(CCCC3)n4c(nc(n4)N)N2
|
|
408
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
409
|
C=CCOc1cccnc1N
|
|
410
|
CC1=CC(=O)N=[S@@](=O)(O1)O
|
|
411
|
CC1=CC(=O)[C@H](C(=N1)SC)C#N
|
|
412
|
c1nc(c(n1Cc2n[n-]nn2)Cl)Cl
|
|
413
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
414
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
415
|
|
|
416
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
417
|
CC1CC(=O)C(CC(=O)[NH]1)CL
|
|
418
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
419
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
420
|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
|
|
421
|
C1CCC2C(C1)CC(=O)[C@@H]3[C@H]2C3
|
|
422
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
423
|
CC1=C(CCO1)C(=O)NCCO
|
|
424
|
C1CCCC(=CC(=O)N)CC1
|
|
425
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
426
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
427
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
428
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
|
429
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
430
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
431
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
432
|
C[C@@H]1CC(=O)Nc2c1c(nn2C)N
|
|
433
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
434
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
435
|
COC(=O)[C@@H]1CCC(=O)c2n1ccc2
|
|
436
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
437
|
c1ccc2c(c1)[nH]c(n2)Nn3cnnc3
|
|
438
|
c1cnccc1[C@@H]2CCC=CC2
|
|
439
|
c1cc(nc2c1n[n-]n2)Cl
|
|
440
|
CC(=O)Nn1cnc2c1cccc2
|
|
441
|
CCCCS(=O)(=O)NCc1nccn1C
|
|
442
|
c1c(c2c(s1)nns2)C#N
|
|
443
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
444
|
Cc1c(non1)c2ccn[nH]2
|
|
445
|
c1cc(cnc1)Br
|
|
446
|
c1coc2c1C(=O)NCCC2
|
|
447
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
448
|
c1cc2c(cc1O)COC2=O
|
|
449
|
CC(=O)Nc1ccccc1NC(=O)C
|
|
450
|
Cc1c(c(n[nH]1)C)[C@@H]2C[C@@H](C=C2)O
|
|
451
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
452
|
c1ccnc(c1)[S@@](=O)c2cncs2
|
|
453
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
454
|
c1cc2c(cc1O)CC(=O)O2
|
|
455
|
CCn1cc(cn1)c2cc[nH]n2
|
|
456
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
457
|
C1Cn2c(=O)[nH]c(=O)nc2N1
|
|
458
|
CSc1c(c([nH]n1)N)C#N
|
|
459
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
460
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
461
|
COC(=O)N1C[C@H]2COC(=O)[C@H]2C1
|
|
462
|
c1c(c(=O)nc2n1CCO2)C#N
|
|
463
|
Cc1cn(c(=O)[nH]1)S(=O)(=O)C
|
|
464
|
Cc1cc2c(c(=O)o1)[C@@H](CO2)O
|
|
465
|
c1cnc2c(n1)c(cs2)N
|
|
466
|
CCc1cc2cnsc2s1
|
|
467
|
c1c2c(c3c(c1Br)non3)nno2
|
|
468
|
c1ccc-2c(c1)CCc3c2nns3
|
|
469
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
470
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
471
|
c1ccc(cc1)C(=O)C(O)O
|
|
472
|
Cc1[nH]c(c(n1)Cl)Cl
|
|
473
|
c1ccc2c(c1)C(=O)N=[S@]2(=O)O
|
|
474
|
c1cncc2c1c(cc(=O)o2)[O-]
|
|
475
|
C1CC(=O)NC[C@@H]1C(F)(F)F
|
|
476
|
COC1NCC(C(N1)[O-])C#N
|
|
477
|
Cn1c-2n/c(=NCc3ccccc3)/n(c2c([nH]c1=O)[O-])CC(=O)[O-]
|
|
478
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
479
|
C1CCN(C1)c2c(nns2)CO
|
|
480
|
c1ccc(cc1)C(=O)c2c3n(nn2)CC(=O)OC34CCCCC4
|
|
481
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
482
|
c1cc(oc1)c2nc([nH]n2)N
|
|
483
|
|
|
484
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
485
|
CCOC(=O)N1CC[C@@H](C=C1)O
|
|
486
|
CCOC(=O)[C@@H]1C=C1C(C)(C)O
|
|
487
|
CC(=C1OC(=O)CC(=O)O1)C
|
|
488
|
COCc1cn(nn1)[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
489
|
CC1=CC=N(=C(C#N)C#N)C=C1
|
|
490
|
C1CC(CCC=C1)CCC(=O)N
|
|
491
|
C1CCC2(C1)NC(CO2)(CO)CO
|
|
492
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
493
|
C(=C(C(F)(F)F)C(F)(F)F)NC(=O)N
|
|
494
|
c1ccc2c(c1)nc3n2C(=O)CC(=N3)[O-]
|
|
495
|
c1nncn1NC(=O)CC#N
|
|
496
|
c1c(non1)c2c(non2)N
|
|
497
|
c1cc(cnc1)C(=O)c2ccco2
|
|
498
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
499
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
500
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
501
|
c1cc(nnc1)Br
|
|
502
|
c1(=O)c(nsnc1Cl)N
|
|
503
|
COC(=O)c1csc2c1nns2
|
|
504
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
505
|
c1ccc(cc1)CN2CC3(CC[C@@H]2C#N)OCCO3
|
|
506
|
c1cc(ccc1N)Sc2nncs2
|
|
507
|
Cc1[nH]c(=O)c2c(n1)C[NH2+]C2
|
|
508
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
509
|
CC1=NN=C2[C@H]1C(=c3ccccc3=[NH+]2)Oc4ccc(cc4)OC
|
|
510
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
511
|
c1cnnc(n1)c2nccnn2
|
|
512
|
C[C@@H]1Cc2c(cn[nH]2)C(=O)C1
|
|
513
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
514
|
C[C@@H]1C=C(C=C(NC1=O)C)C
|
|
515
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
516
|
c1ccc(cc1)N2CCNC2=O
|
|
517
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
518
|
c1ccc(cc1)NC2=NC(=O)CC(=N2)[O-]
|
|
519
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
520
|
c1csc2c1c(n[nH]c2=O)N
|
|
521
|
CCOC(=O)C1=C(NC(=N[C@@H]1c2ccccc2)O)C
|
|
522
|
|
|
523
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
524
|
c1c[nH]nc1c2nccs2
|
|
525
|
c1cnnc2c1-c3c(non3)CC2
|
|
526
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
527
|
c1ccc(cc1)[C@@H]2[C@@H]([C@@H](OC3=C2CCCC3)N)C#N
|
|
528
|
Cn1c(ccn1)[C@@H](c2cccs2)O
|
|
529
|
|
|
530
|
C1=C[C@H]2[C@H]3C=C[C@@H]([C@@H]1C(=O)N2)NC3=O
|
|
531
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
532
|
Cc1ccc(n1NC(=O)C)C
|
|
533
|
c1cc(sc1)CC(=O)n2cnnc2
|
|
534
|
C1[C@@H](NCC1(F)F)C(=O)N
|
|
535
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
536
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
537
|
CC1C(NON1)C(=O)N(C)C
|
|
538
|
Cc1ccc(o1)/C=C(C)/CO
|
|
539
|
|
|
540
|
CC1=CC(=NS(=O)(=O)N1)C
|
|
541
|
CC(=O)NCC1CNCCN1
|
|
542
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=NC(=N2)N3CCOCC3)[O-]
|
|
543
|
c1csc2c1cc([nH]2)C(=O)[O-]
|
|
544
|
c1cnsc1C(=O)N2CC(C2)F
|
|
545
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
546
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
547
|
CC1=C2[C@@H](C(C=C2[C@@](C(=O)C13CC3)(C)O)(C)C)O
|
|
548
|
C1CC2(CC2)[C@@H]3[C@@H]1NC(=O)C3
|
|
549
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
550
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
551
|
c1cc(sc1)Cc2[n-]nnn2
|
|
552
|
CCCCc1[nH]cc([nH+]1)CO
|
|
553
|
c1c2c([nH]c1C(=O)[O-])nco2
|
|
554
|
c1c[nH]c2c1c(ncc2)Cl
|
|
555
|
|
|
556
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
557
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
558
|
Cc1cnc(nc1c2ncnn2C)N
|
|
559
|
c1cc(c2nncn2c1)Cl
|
|
560
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
561
|
Cc1nnc(o1)CSc2ccccn2
|
|
562
|
CCOC(=O)N1CCC2C([NH]OC2=O)CC1
|
|
563
|
CC1(OC[C@H]([C@@H](CO1)O)O)C
|
|
564
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
565
|
|
|
566
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
567
|
Cc1c2c([nH]n1)CCOC(=O)N2
|
|
568
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
569
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
570
|
c1cnccc1c2nnc3n2CCC3
|
|
571
|
CSC1C2C(CCN1)N[NH]N2
|
|
572
|
c1ccc(cc1)C#CCNc2[n-]nnn2
|
|
573
|
C=Cn1cccc1c2ccco2
|
|
574
|
c1cc(sc1)c2ccno2
|
|
575
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
576
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
577
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
578
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
579
|
c1ccc2c(c1)NC(=O)CCO2
|
|
580
|
CN(C)c1nc(c(c(=O)o1)C#N)OC
|
|
581
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
582
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
583
|
Cc1ccc(cc1)n2cnnc2
|
|
584
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
585
|
CCOC(=O)C1=NOC(=O)[C@H]1C
|
|
586
|
C1=CC2=CC(=O)O[C@@H]2[C@@H]([C@@H]1O)O
|
|
587
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
588
|
Cc1c2c(nnn2[O-])n(n1)C
|
|
589
|
C[C@@]12CCC(=O)N1C3CNCNC3N2
|
|
590
|
c1cc(=O)oc2c1CCCC2
|
|
591
|
Cc1ccc(n1n2cnnc2)C
|
|
592
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
593
|
|
|
594
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
595
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
596
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
597
|
CC1=CNC(=O)CC(C1)(C)C
|
|
598
|
c1cncc2c1nc(o2)Cl
|
|
599
|
CS(=O)(=O)Nc1ccccn1
|
|
600
|
c1c(c2c(nc[nH]2)nn1)Cl
|
|
601
|
CCn1c(c(nn1)C(=O)N)N
|
|
602
|
c1ccc(c(c1)C(=O)[O-])S[C@@H]2CCC(=O)N2
|
|
603
|
CC(=O)Nc1c(cn[nH]1)C#N
|
|
604
|
CC1=NC[C@@H](O1)c2ccccc2
|
|
605
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
606
|
Cn1cccc1CNc2[n-]nnn2
|
|
607
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
608
|
C=CCc1cc(ccc1O)O
|
|
609
|
CC1(OC(=C(O1)C(=O)N)C(=O)N)C
|
|
610
|
c1c(n2c(n1)CCC2)C(=O)[O-]
|
|
611
|
CCNC(=O)n1c(nnn1)N
|
|
612
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
613
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
614
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
615
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
616
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
617
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
618
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
619
|
C(C(=O)[O-])n1c(nnc1Cl)Cl
|
|
620
|
c1cc(cnc1)CS(=O)(=O)N
|
|
621
|
c1cc(oc1)Cn2c3c(nc2Cl)CCC3
|
|
622
|
c1cnnc2c1c(c(s2)C(=O)N)N
|
|
623
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
624
|
c1coc2c1cc(cc2O)F
|
|
625
|
CC(C)[C@@H]1n2cccc2C(=O)O1
|
|
626
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
627
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
628
|
COc1ccc2nnnn2n1
|
|
629
|
c1ccc2c(c1)[C@@H](NCCO2)c3cccs3
|
|
630
|
Cc1c(ccc(n1)Cl)C#N
|
|
631
|
c1cc(n[nH]c1=O)NC2CC2
|
|
632
|
CC(C)Oc1c(c(=O)c1=O)c2ccco2
|
|
633
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
634
|
Cn1c2c(cn1)nc[nH]c2=O
|
|
635
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
636
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
637
|
COC1CC2C(CC1O)-C3C(CNO3)CCC2
|
|
638
|
c1ccc2=NC3=[NH+]CCN3C(=c2c1)[O-]
|
|
639
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
640
|
C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)N)O)O)O
|
|
641
|
C1CC2C(CC1N)C=CCS2
|
|
642
|
c1nc([nH]n1)c2c(non2)N
|
|
643
|
CN1NC(NN1)C2[N-]NNN2
|
|
644
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
645
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
646
|
Cc1c(c(n[nH]1)C)NC(=O)C
|
|
647
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
648
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
649
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
650
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
651
|
C/C=c/c(cc(n/c1=C(C)/O)C)n2cncn2
|
|
652
|
C1CCN(C1)C2CC[NH2+]CC2
|
|
653
|
c1cnoc1NC(=O)N2CCOCC2
|
|
654
|
c1cnccc1c2cc3c(o2)CCNC3=O
|
|
655
|
C1CCC2C(C1)C(=O)N3C(S2)NC(N3)N
|
|
656
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
657
|
Cc1cc(no1)NC(=O)CCn2c(=O)cc3c(n2)CCC3
|
|
658
|
c1c2c(nc(n1)N)SCC2
|
|
659
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
660
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
661
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
662
|
c1ccc(cc1)n2c3c(cn2)C(=O)CC3
|
|
663
|
CCNC(=O)Oc1c2ccccc2on1
|
|
664
|
Cc1c[nH]nc1C(F)(F)F
|
|
665
|
c1c2c(nc(n1)N)CCOC2
|
|
666
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
667
|
c1cc2c(c(c1)F)ncnc2n3ccnc3
|
|
668
|
Cc1c(c(ns1)SC)C#N
|
|
669
|
Cn1c(=O)c(c(s1)Cl)C#N
|
|
670
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
671
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
672
|
CC1CN(C2C1-C3C(CN[NH]3)CC2)C
|
|
673
|
c1cn2c(cc1=O)C(=O)NCC2
|
|
674
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
675
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
676
|
CC(=O)c1coc(cc1=O)O
|
|
677
|
c1cocc1/C=C/2C(=NC(=O)N2)[O-]
|
|
678
|
CN1CNC(=O)c2c1n[nH]n2
|
|
679
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
680
|
c1cc(oc1)c2cc(=O)n3cnnc3s2
|
|
681
|
C=CCOc1ccc(cc1)O
|
|
682
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
683
|
|
|
684
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
685
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
686
|
c1ccc(cc1)[C@@H]2CCC(=O)O2
|
|
687
|
Cc1cc(no1)c2nnc(o2)N
|
|
688
|
c1cc(cnc1)c2cccs2
|
|
689
|
CCOc1c(=O)c(=O)c1OCC
|
|
690
|
c1c(nc(o1)N)C(F)(F)F
|
|
691
|
Cc1cc(n(n1)c2[n-]nnn2)C
|
|
692
|
c1csc(n1)n2cnnc2
|
|
693
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
694
|
c1cc(oc1)c2nsc(=O)o2
|
|
695
|
c1cc(sc1)c2[n-]nnn2
|
|
696
|
COC(=O)c1cc2c(n1C(=O)OC)snn2
|
|
697
|
Cc1cc(=O)n2c(c1C#N)SCC2
|
|
698
|
C1CCC(CC1)(O)O[S@@](=O)O
|
|
699
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
700
|
c1ccc(cc1)Oc2c(non2)N
|
|
701
|
Cc1cc2c(o1)ccc3c2non3
|
|
702
|
c1ccnc(c1)SCCn2cccn2
|
|
703
|
CCCCn1ccc(=N)cc1
|
|
704
|
c1ccc(cc1)n2cnc(nc2=[NH2+])N
|
|
705
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
706
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
707
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
708
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
709
|
CNc1ccc(cc1F)C#N
|
|
710
|
CS(=O)(=O)Nn1cnnc1
|
|
711
|
CC(C)(C)c1ccc(=O)[nH]n1
|
|
712
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
713
|
CCO[C@@H](C=C)n1cncn1
|
|
714
|
c1ccc(cc1)COc2c(non2)N
|
|
715
|
c1cc2c(cc1I)C3=C(C2)C(=O)NCC3
|
|
716
|
C1CC2C(C(N[NH]C2=O)[O-])C1
|
|
717
|
C1CCC(CC1)Nc2nnns2
|
|
718
|
Cc1c(c(sn1)C(=O)[O-])N
|
|
719
|
C1CCC(CC1)/C=C/CN2CCNC2C3CNCCN3
|
|
720
|
c1cnccc1CSc2nncs2
|
|
721
|
|
|
722
|
c1ncn(n1)Sn2cncn2
|
|
723
|
C1Cn2c(nnc2SC1)N
|
|
724
|
Cc1cc2n(c(=O)c1C#N)CCO2
|
|
725
|
C#CC1(CCCCCCC1)O
|
|
726
|
c1ccc2ccc(=O)ccc2c1
|
|
727
|
C/C=C/[C@@H]1[C@@H]([C@@H](C2=C(O1)[C@@](OC2=O)(C)O)O)O
|
|
728
|
CC(C)Oc1cc(on1)C#N
|
|
729
|
CCc1ccc(cc1)N2C(=O)CC(=O)N=C2O
|
|
730
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
731
|
CC(C)n1c(c(cn1)C#N)N
|
|
732
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
733
|
c1ccc2c(c1)ncc3n2c(=O)on3
|
|
734
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
735
|
CC(C)(c1cccn1C=C)O
|
|
736
|
CS(=O)(=O)NC[C@@H]1CCCO1
|
|
737
|
Cn1cnc2c(c(nn2c1=O)C#N)C#N
|
|
738
|
c1cc(oc1)c2c(snn2)C(=O)[O-]
|
|
739
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
740
|
CC12C(NC(=O)N1)NC(=O)N2
|
|
741
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
742
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
743
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
744
|
COC(=O)N1CCCNC(=O)C1
|
|
745
|
Cc1[nH]c(=O)c2c(n1)CCC2
|
|
746
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
747
|
CC(C)N1CC(=C(C1=O)C#N)[O-]
|
|
748
|
c1[nH]c(=O)c2c(n1)c(c3n2CCCC3)C#N
|
|
749
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
750
|
CCN1CC(=C(C=C1O)C)C(=O)N
|
|
751
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
752
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
753
|
c1ccc2c(c1)N3C[C@H](CN=C3S2)O
|
|
754
|
[H]/N=c/n(c(c(s1)C#N)N)C=C
|
|
755
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
756
|
c1cc(ncc1C#N)NCc2nccs2
|
|
757
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
758
|
CC1=Cc2ccccc2C=C[C@@H]1O
|
|
759
|
c1c2cc(oc2ncc1F)CO
|
|
760
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
761
|
c1csc2c1sc(c2)C(=O)[O-]
|
|
762
|
c1ccc2c(c1)C(=O)OS(=O)(=O)N2
|
|
763
|
|
|
764
|
CCOC(=O)/N=c/1ccccn1[O-]
|
|
765
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
766
|
c1cc2c3c(c1)OCc3cc(=O)o2
|
|
767
|
Cc1c(nnn1C)c2csnn2
|
|
768
|
c1ccc(cc1)c2ccncn2
|
|
769
|
Cc1cc(n(n1)Cn2ccccc2=O)C
|
|
770
|
c1csc2c1ncnc2n3ccnc3
|
|
771
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
772
|
CCS(=O)(=O)Nc1ccn(n1)C
|
|
773
|
|
|
774
|
|
|
775
|
CC1=C(Cc2c(c(=O)c2=O)C1)C
|
|
776
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
777
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
778
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
779
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
780
|
c1c(nc[nH]1)C[C@@H]2C(=O)N3CCC[C@@H]3C(=O)N2
|
|
781
|
Cc1nc(co1)/C=C(C)/CO
|
|
782
|
C[C@@H]1[C@@H](C(=O)OC1(C)C)c2[n-]nnn2
|
|
783
|
Cc1cc(=O)c(c(o1)Nc2nnns2)C(=O)C
|
|
784
|
CC1NCC2N1C=CN([C@@H]2O)C(=O)C
|
|
785
|
c1ccc2c(c1)C[C@@H]3[C@@H](C2)NC3=O
|
|
786
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
787
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
788
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
789
|
CN1C(=O)CC=C1CC(=O)OC
|
|
790
|
CCCn1c(nnn1)COn2c3cc(ccc3nn2)Cl
|
|
791
|
CC(=O)n1c2c(c(c1N)C#N)CC(OC2)(C)C
|
|
792
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
793
|
c1cc(c(nc1)n2cncn2)N
|
|
794
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
795
|
CC1[NH]C(=O)C(CN1)CC=C
|
|
796
|
CN(C)C(=O)Nc1cnns1
|
|
797
|
Cc1ccc(cc1)c2nnco2
|
|
798
|
Cc1ccc(nc1)n2cnnn2
|
|
799
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
800
|
CNc1ccc(cc1)C(=O)[O-]
|
|
801
|
c1c[nH]c2c1sc(c2)C(=O)[O-]
|
|
802
|
c1cc2c(cc1Cl)-c3c(c[nH]n3)CS2
|
|
803
|
c1ccc2c(c1)nnn2c3cnns3
|
|
804
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
805
|
c1cc(nnc1n2cncn2)[O-]
|
|
806
|
c1nc(no1)c2c(non2)N
|
|
807
|
c1ccc(cc1)[C@@H]2NC(=[NH2+])Nc3n2c4ccccc4n3
|
|
808
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
809
|
C(#N)c1c(c([nH]c1N)Br)C#N
|
|
810
|
CCO/C=CCC1(CCCC1)O
|
|
811
|
Cc1cc(c(c(=O)n1c2nnns2)C(=O)C)[O-]
|
|
812
|
c1cnccc1c2n[nH]c(=O)s2
|
|
813
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
814
|
C([C@@H]1[C@@H]([C@@H]([C@@H](O1)O)O)O)O
|
|
815
|
c1nc(nn1CC(=O)N)C#N
|
|
816
|
C1CC1N2C[C@@H](CC2=O)CO
|
|
817
|
CN1C(=O)CC[C@@]1([C@@H]2CC=CC=C2)O
|
|
818
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
819
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
820
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
821
|
C/C=C/c1c2c(on1)C[C@@H](OC2=O)C
|
|
822
|
c1cc(ccc1c2ncc(cn2)O)O
|
|
823
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
824
|
CCCCO[C@@H](C)n1cnnc1
|
|
825
|
c1c(cn[nH]1)I
|
|
826
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
827
|
Cc1ccc(n1c2cnccn2)C
|
|
828
|
Cc1cc(=O)n2c(csc2c1C#N)C
|
|
829
|
c1ccc(cc1)/C(=C/2C(=O)CC(=O)N2)/[O-]
|
|
830
|
CCOC(=O)C[C@@H](CF)O
|
|
831
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
832
|
CSc1ccc(s1)C#N
|
|
833
|
c1c(=O)nc2n3c1NC(=O)Cc3cs2
|
|
834
|
c1cc2c(c(c1)Cl)nc[nH]2
|
|
835
|
Cc1c(c(sn1)C)Nc2c(c(ncn2)SC)C#N
|
|
836
|
c1ccc2c(c1)ncn2n3cccc3
|
|
837
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
838
|
Cc1ccc(cc1)N=S=O
|
|
839
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
840
|
|
|
841
|
CCOC(=O)[C@@H]1[C@@](C(=NC(=O)N1)[O-])(C)Br
|
|
842
|
C=CCNc1cn[nH]c(=O)n1
|
|
843
|
CCn1cc(cn1)c2ccno2
|
|
844
|
c1cc(oc(=O)c1)c2cccnc2
|
|
845
|
C[C@@H]1CNC(=O)C2=C1N=C(C2)c3ccncc3
|
|
846
|
[H]/N=c/1onc(s1)c2c(non2)N
|
|
847
|
Cc1ccc(cc1)n2ccnc2
|
|
848
|
c1cncc2c1sc(n2)Cl
|
|
849
|
C1C=C2C(=C[C@@]1(CCO)N)OCO2
|
|
850
|
c1cnccc1n2cc(cn2)N
|
|
851
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
852
|
Cc1c(con1)c2ccccc2
|
|
853
|
c1cnn(c1)c2nncn2N
|
|
854
|
COC(=O)c1ccc(o1)C#N
|
|
855
|
COC(=O)N1CCc2c(s[nH]c2=O)C1
|
|
856
|
C1C[C@@H](OC1)c2nnc(o2)N
|
|
857
|
Cc1cc(nn2c1nnc2)O
|
|
858
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
859
|
CN1CC(=O)c2ccccc2S1(=O)=O
|
|
860
|
Cc1cc2cccc(c2o1)n3cnnn3
|
|
861
|
CC1=Nc2c(cccn2)NC(=O)C1
|
|
862
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
863
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
864
|
Cc1c(nc(nn1)N)/C=C/c2cc(cc3c2cccc3)O
|
|
865
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
866
|
c1ccc(cc1)CNc2cnccn2
|
|
867
|
Cc1c(oc(n1)Sc2cnc3ccccc3n2)C
|
|
868
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
869
|
Cc1nc(cs1)c2cc(no2)CO
|
|
870
|
c1c2c(sc1Cl)S(=O)(=O)NC[C@@H]2O
|
|
871
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
872
|
C1C(=O)N[C@@H]2C=CC=CN2C1=O
|
|
873
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
874
|
C=C1C=C(C(=O)Nc2ccccc2N1)O
|
|
875
|
C1C[C@@H]2C(=O)NCC(=O)N2C1
|
|
876
|
CC(=O)O/C=C/CC(=O)OC
|
|
877
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
878
|
Cc1cn(cn1)c2cccnc2
|
|
879
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
880
|
CC1C(NNC(C1C#N)SC2CC(CCC2F)F)C
|
|
881
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
882
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
883
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
884
|
c1ccc(cc1)c2cscn2
|
|
885
|
c1ccc2c(c1)NCCC(=O)N2
|
|
886
|
CC(C)(C)c1cnnc(n1)N
|
|
887
|
CNc1nnc(s1)c2cnccn2
|
|
888
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
889
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
890
|
C1CCC2C(C1)C=CC=CS2(=O)=O
|
|
891
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
892
|
Cc1c2cnnc(c2c([nH]1)C)[O-]
|
|
893
|
c1ccc(cc1)Oc2ccccn2
|
|
894
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
895
|
CC1CCC(N1N2C(NNN2)N)C
|
|
896
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
897
|
c1ccc(cc1)c2cc(=O)c2=O
|
|
898
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
899
|
C1C[NH+]=CC=C(N1)C(F)(F)F
|
|
900
|
CC1CC(N(N1)C2=N[C@@]3([C@@](N2)(NC(=O)N3)C)C)C
|
|
901
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
902
|
Cc1cc(nc(n1)SCC2=NC(Cc3c2cccc3)(C)C)C
|
|
903
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
904
|
c12c([nH]c(=O)nc1nc([nH]2)Br)[O-]
|
|
905
|
COC(=O)Cc1cccnn1
|
|
906
|
c1ccc(cc1)Nc2nnns2
|
|
907
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
908
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
909
|
c1ncn(n1)CCn2cncn2
|
|
910
|
C(#N)C(C(C#N)(F)F)(F)F
|
|
911
|
Cc1cccc(n1)n2ccnc2
|
|
912
|
CNc1nc(ns1)c2cccs2
|
|
913
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
914
|
c1cc2c(cc1F)CCNC2
|
|
915
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
916
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
917
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
918
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
919
|
C=CC[C@@H]1CCCCC(=O)N1
|
|
920
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
921
|
Cc1cc(c(o1)C)c2cc[nH]n2
|
|
922
|
c1cc(nnc1n2ccnc2)[O-]
|
|
923
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
924
|
CCSc1nncn1Cc2ccco2
|
|
925
|
c1cc2cn[nH]c2c(c1)S(=O)(=O)[O-]
|
|
926
|
CC1NC(ON1)C2CNCCN2
|
|
927
|
C1CNc2c(c(=O)c2=O)NC1
|
|
928
|
c1ccc(cc1)Cn2c(nnc2Cl)C3CC3
|
|
929
|
c1cn(cn1)Cc2cnc(s2)Cl
|
|
930
|
C1COCCC1(CC#N)C#N
|
|
931
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
932
|
C1CCC(CC1)CON2CCCC2C#N
|
|
933
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
934
|
C=CCNC1CCNC(N1)N
|
|
935
|
CC(=C)c1nc(co1)C(=O)[O-]
|
|
936
|
c1cc(oc1)CSc2ccc(cc2)n3cnnn3
|
|
937
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
938
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
939
|
c1cc2c(cc1Cl)-c3c(snn3)CS2(=O)=O
|
|
940
|
c1ccc(cc1)n2c3c(cn2)c(ncn3)N
|
|
941
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
942
|
c1ccc(cc1)C2=NC23c4ccccc4-c5c3cccc5
|
|
943
|
C[C@@H]1Nc2ccccc2-c3c(nc(nn3)SC)O1
|
|
944
|
Cc1c2c(n[nH]1)CC(C=C2)(C)C
|
|
945
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
946
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
947
|
[H]/N=c/n(ccs1)CC(=O)[O-]
|
|
948
|
CO[C@@H]1C=C[C@@H]([C@@H](O1)CO)O
|
|
949
|
CCN1CCc2c(c([nH]c(=O)c2C#N)[O-])C1
|
|
950
|
CC1=C[C@@H](CC(=O)N1)c2ccco2
|
|
951
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
952
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
953
|
CNC1=N[C@@H]2CCCC[C@@H]2O1
|
|
954
|
c1ccc2c(c1)CNC(=O)CN2
|
|
955
|
c1ccc2c(c1)cccc2Cl
|
|
956
|
C1(=NS(=O)(=O)N=C1O)O
|
|
957
|
c1ccnc(c1)CCSc2nncs2
|
|
958
|
Cc1cc(cc2n1nnn2)O
|
|
959
|
c1ccc(cc1)c2nc(=[NH2+])sn2c3ccccc3
|
|
960
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
961
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
962
|
c1ccc2c(c1)c(=O)ccs2
|
|
963
|
Cn1cccc1CCn2ccnc2
|
|
964
|
COC(=O)c1cccc2c1c([nH]n2)Br
|
|
965
|
c1c(=O)nc2n3c1NC(=O)C[C@@]3(CS2)O
|
|
966
|
CCCC(=O)OCOC(=O)/C=C(C)/N
|
|
967
|
C#CCSc1nn2cnnc2o1
|
|
968
|
CN(C)S(=O)(=O)OC1CCC(CC1)N
|
|
969
|
CC(=O)OC/C=C/OC(=O)C
|
|
970
|
C1CC([NH]C1)C(=O)OCC#N
|
|
971
|
Cc1cc(c(nn1)N)C(=O)N
|
|
972
|
COCCC/N=C/[C@@H](C(=O)C1=O)NCCO
|
|
973
|
CCOC(=O)C1=C(C=C[C@@H]1c2ccccc2)N
|
|
974
|
C1CS(=O)(=O)N=C2N1C=CC=N2
|
|
975
|
CS(=O)(=O)Nc1nccs1
|
|
976
|
c1ccc(cc1)Oc2ccoc2
|
|
977
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
978
|
Cn1cnc2c1ncc(c2)C#N
|
|
979
|
CC(=O)OC/C=C/c1cccnc1
|
|
980
|
c1ccc2c(c1)c(cc(=O)[nH]2)N
|
|
981
|
c1cc(cc(c1)OCc2cscn2)N
|
|
982
|
C1CCC2C(C1)[C@@H]3CC[C@H]2NC3=O
|
|
983
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
984
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
985
|
c1coc2c1c(=O)[nH]nc2[O-]
|
|
986
|
c1cc(cnc1)Cc2nc(=O)[nH]c(=O)s2
|
|
987
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
988
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
989
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
990
|
CC1(NC(=O)[C@@H](O1)/C=C/C2CCCCC2)C
|
|
991
|
COC1=CC(=O)O[C@@H]1CC#N
|
|
992
|
Cc1c(cn(n1)C)n2cnnn2
|
|
993
|
c1csc2c1NCCNC2=O
|
|
994
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
995
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
996
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
997
|
CC(=O)c1cc2c(s1)SCC(=O)N2
|
|
998
|
c1cc2c(c(c1)S(=O)(=O)[O-])nn[nH]2
|
|
999
|
C1CCC2C(C1)C(=O)OCCS2
|
|
1000
|
c1ccc(c(c1)C(=O)[C@@H]2C(=NN=N2)C(F)(F)F)O
|
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