(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
2
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
3
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
4
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
5
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
6
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
7
|
c1cc(nnc1n2cnnn2)Cl
|
|
8
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
9
|
C1CCC2C(C1)CC[C@@H]2CC3CCCCN3
|
|
10
|
Cn1ccnc1CSc2nncn2C3CC3
|
|
11
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
12
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
13
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
14
|
Cc1cc(no1)CSc2ccccn2
|
|
15
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
16
|
Cc1ccc(nc1)n2cnnn2
|
|
17
|
c1cc(oc1)c2csc3c2c(=O)[nH]cn3
|
|
18
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
19
|
c1ccc(cc1)c2cccnn2
|
|
20
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
21
|
c1nc(no1)c2c(non2)N
|
|
22
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
23
|
c1cc(oc1)c2nsc(=O)o2
|
|
24
|
c1ccnc(c1)[S@@](=O)c2cncs2
|
|
25
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
26
|
C(c1c(non1)N)c2c(non2)N
|
|
27
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
28
|
c1ccnc(c1)SCc2c(snn2)Cl
|
|
29
|
Cc1nc2ccccc2c(=O)n1c3nc[nH]n3
|
|
30
|
c1csc(n1)n2cnnn2
|
|
31
|
c1ccc(cc1)Sc2ccccn2
|
|
32
|
c1cc(c(nc1)n2cccn2)N
|
|
33
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
34
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
35
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
36
|
c1c[nH]nc1c2nccs2
|
|
37
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
38
|
CS(=O)(=O)NCc1ccccn1
|
|
39
|
c1cnn(c1)CN2CCCC2
|
|
40
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
41
|
Cc1c2ccccc2nc(c1C(=O)[O-])Cn3cccn3
|
|
42
|
CCOC(=O)c1nccnn1
|
|
43
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
44
|
CCCCCCC1CN[NH]N1
|
|
45
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
46
|
c1cc(nnc1n2cncn2)[O-]
|
|
47
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
48
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
49
|
c1c[nH]nc1C2CCCCC2
|
|
50
|
CCOC(=O)c1cccnn1
|
|
51
|
c1cnn(c1)CCSc2nncs2
|
|
52
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
53
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
54
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
55
|
Cc1nc(cn1C)S(=O)(=O)Oc2ccccc2F
|
|
56
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
57
|
C=Cn1cccc1c2ccco2
|
|
58
|
|
|
59
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
60
|
CC(C)(C)NC(=O)c1[nH]ccn1
|
|
61
|
Cc1c[nH]nc1C(F)(F)F
|
|
62
|
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
|
|
63
|
CC(=O)c1c(c(c(s1)SC)C#N)c2ccco2
|
|
64
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
65
|
c1ccnc(c1)SCc2ccco2
|
|
66
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
67
|
CN(C)[C@@H](C#N)c1ccco1
|
|
68
|
Cc1ccc(n1c2cc(on2)C)C
|
|
69
|
Cn1c(c(c(=O)[nH]c1=O)Oc2ccc(cc2Cl)F)N
|
|
70
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
71
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
72
|
|
|
73
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
74
|
Cc1c(cc2cc[nH]c2n1)C#N
|
|
75
|
Cc1cc(c2cccc(c2n1)O)n3cccn3
|
|
76
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
77
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
78
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
79
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
80
|
c1cnc(cn1)c2nnc(o2)N
|
|
81
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
82
|
Cc1nnc(o1)CSc2ccccn2
|
|
83
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
84
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
85
|
Cc1ccc(n1c2cnccn2)C
|
|
86
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
87
|
c1ccnc(c1)SCCn2cccn2
|
|
88
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
89
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
90
|
c1cc(ncc1C#N)NCc2nccs2
|
|
91
|
c1cc(sc1)C(=O)/C=C/2C(=O)NCCN2
|
|
92
|
CCS(=O)(=O)Nc1ccn(n1)C
|
|
93
|
|
|
94
|
Cn1c(c(c(=O)[nH]c1=O)Sc2nc3ccccc3s2)N
|
|
95
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
96
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
97
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
98
|
CCC1=Cn2c3ccccc3c4c2c(ccc4)C1
|
|
99
|
c1cnnc(n1)c2nccnn2
|
|
100
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
101
|
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](C=C1)O
|
|
102
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
103
|
c1cc(cc(c1)OCc2cscn2)N
|
|
104
|
c1ccc(cc1)CNc2cnccn2
|
|
105
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
106
|
c1ccc(cc1)Sc2nccs2
|
|
107
|
c1ccc2c(c1)C[NH2+]C2=C(C#N)C#N
|
|
108
|
c1ccc(cc1)Oc2c(non2)N
|
|
109
|
Cc1c(c(no1)C(=O)OC)c2cc[nH]n2
|
|
110
|
Cc1cc(c(s1)C)[C@@H]2C=CN=CN2
|
|
111
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
112
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
113
|
Cc1nnc(s1)Sc2c(n(c(=O)[nH]c2=O)C)N
|
|
114
|
CC1NC(NO1)C2(CCCC2)NC(=O)C
|
|
115
|
CCOC(=O)C1=C(Sc2ccccc2C1)NC(=O)C
|
|
116
|
c1csc2c1CCO[C@@H]2CC(=O)[O-]
|
|
117
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
118
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
119
|
c1cc(oc1)C(=O)c2cccs2
|
|
120
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
121
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
122
|
[H]/N=c/n(c(co1)C)CC(=O)c2ccc(cc2)C
|
|
123
|
CC(=O)c1c(cc(cn1)C(F)(F)F)n2cncn2
|
|
124
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
125
|
c1cc(oc1)c2nccs2
|
|
126
|
Cc1nc(no1)c2ncon2
|
|
127
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
128
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
129
|
c1cc(c(nc1)n2cncn2)N
|
|
130
|
c1cc(sc1)C(=O)n2cccn2
|
|
131
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
132
|
c1cnoc1c2nnc(o2)N
|
|
133
|
c1cnn(c1)Cn2cc(cn2)N
|
|
134
|
CCS(=O)(=O)NCCn1cccn1
|
|
135
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
136
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
137
|
c1ncn(n1)Cn2cncn2
|
|
138
|
c1cc(n[nH]c1=O)NC2CC2
|
|
139
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
140
|
c1cc(ncc1C#N)Sc2nccs2
|
|
141
|
CC(=O)c1n[nH]c2n1ncc2
|
|
142
|
c1cc(oc1)Cn2c(ccn2)N
|
|
143
|
c1ccc2c(c1)SC(=Cc3ccco3)S2
|
|
144
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
145
|
c1cnc2c(n1)C(=O)NCN2
|
|
146
|
CCCNC(=O)Cc1nc[nH]n1
|
|
147
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
148
|
|
|
149
|
Cn1c(nnc1SC)CSc2ncccn2
|
|
150
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
151
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
152
|
c1ccc(cc1)c2cnccn2
|
|
153
|
c1cc(cnc1)CCNCc2cscn2
|
|
154
|
CC(C)(C)c1ccc(=O)[nH]n1
|
|
155
|
c1ncn(n1)CCn2cncn2
|
|
156
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
157
|
C/C(=C/1CCOC1=O)/NC(=O)C
|
|
158
|
CCc1nc2ccccc2c(=O)n1N
|
|
159
|
c1cc(oc1)c2c(ncs2)C(=O)[O-]
|
|
160
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
161
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
162
|
CN(CCn1cccn1)c2ccccc2
|
|
163
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
164
|
c1ccc(cc1)COc2c(nccn2)N
|
|
165
|
c1cc(oc1)C(=O)c2nccs2
|
|
166
|
c1cc(oc1)c2nc(on2)CO
|
|
167
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
168
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
169
|
CC1NC(ON1)C2CNCCN2
|
|
170
|
c1csc(n1)/N=C(/CN2CCOCC2)[O-]
|
|
171
|
COC(=O)C[C@@H]1Cn2c(nc(n2)C(F)(F)F)N=C1[O-]
|
|
172
|
Cc1nc(no1)CSc2ccccc2
|
|
173
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
174
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
175
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
176
|
Cc1cc(no1)c2nnc(o2)N
|
|
177
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
178
|
CC1=COC(=O)c2ccccc2N1
|
|
179
|
CS(=O)(=O)Nc1ccccn1
|
|
180
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
181
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
182
|
c1ccc(cc1)Cn2c(=O)[nH]c(=O)cn2
|
|
183
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
184
|
c1cc2c3c(c(ncn3)n4cccn4)sc2nc1
|
|
185
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
186
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
187
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
188
|
c1ccc(cc1)Oc2ccccn2
|
|
189
|
c1ccc(cc1)n2c(ncn2)CN3CCCC3=O
|
|
190
|
c1ccc(cc1)NCC(=O)[O-]
|
|
191
|
|
|
192
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
193
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
194
|
c1ccc(cc1)Sc2ccn[nH]2
|
|
195
|
CN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)NC1=O)O
|
|
196
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
197
|
Cc1nnc(o1)CSc2nccn2C
|
|
198
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
199
|
Cc1cc(n(n1)CCc2nnc(n2C)SC)C
|
|
200
|
c1ccc2c(c1)cccc2C[C@@H]3NCC=N3
|
|
201
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
202
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
203
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
204
|
c1c2c(sc1Cl)S(=O)(=O)NC[C@@H]2O
|
|
205
|
c1cc(sc1)c2[nH]ccn2
|
|
206
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
207
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
208
|
c1ncn(n1)NCNn2cncn2
|
|
209
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
210
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
211
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
212
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
213
|
c1c[nH]c2c1ncc(n2)Cl
|
|
214
|
c1ccnc(c1)CCSc2nncs2
|
|
215
|
Cc1cnnn1c2c(nn(c2C)C)C
|
|
216
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
217
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
218
|
c1cnccc1CSc2nncs2
|
|
219
|
CC1=Nc2ccccc2NC(C1)(C)C
|
|
220
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
221
|
c1ccc(cc1)[N-]S(=O)(=O)N2CCOC2=O
|
|
222
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
223
|
C1Cn2c(=O)[nH]c(=O)nc2N1
|
|
224
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
225
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
226
|
c1cc(ccc1N)Sc2nncs2
|
|
227
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
228
|
CS(=O)(=O)c1cccnn1
|
|
229
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
230
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
231
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
232
|
Cc1c2c([nH]n1)C(=O)N([C@@H]2c3ccco3)C
|
|
233
|
c1cc(sc1)c2c(non2)N
|
|
234
|
Cc1cnc(o1)CSc2ccccc2
|
|
235
|
c1cc2c([nH]nc2Cl)nc1
|
|
236
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
237
|
c1cc(sc1)c2ccon2
|
|
238
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
239
|
CCSc1cc(ncn1)N
|
|
240
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
241
|
c1cc(sc1)c2ccncn2
|
|
242
|
c1c(cncc1Cl)OC(=O)C2=NC=CC2
|
|
243
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
244
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
245
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
246
|
CCC(=O)Cc1cnccn1
|
|
247
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
248
|
[H]/N=c/1onc(s1)c2c(non2)N
|
|
249
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
250
|
CCOC(=O)Cc1[nH]ncn1
|
|
251
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
252
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
253
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
254
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
255
|
CC1(C=C(c2cnccc2O1)N3CCCC3=O)C
|
|
256
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
257
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
258
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
259
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
260
|
c1c[nH]nc1C(=O)Nc2nccs2
|
|
261
|
c1nc(c(n1CCO)N)C#N
|
|
262
|
c1ccc2c(c1)cnn(c2=O)Cc3ccon3
|
|
263
|
C1CC(OC1)CNC2=NCCO2
|
|
264
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
265
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
266
|
Cc1cc(n(n1)C2=NCCN2)C
|
|
267
|
C1CCC(CC1)NC(=O)CC2CCCO2
|
|
268
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
269
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
270
|
C1CC(OC1)C(=O)CN2CCC(=O)CC2O
|
|
271
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
272
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
273
|
Cc1cnc(o1)Cn2cccn2
|
|
274
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
275
|
CC1(COC(=N1)c2ccco2)C
|
|
276
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
277
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
278
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
279
|
c1cnn(c1)Cc2cnc(s2)Cl
|
|
280
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
281
|
CCCCN/C(=CC1=NCCC1)/C
|
|
282
|
c1ccc2c(c1)C[C@@H]3CC[C@@H](C3=N2)O
|
|
283
|
C=CCN1[C@@H]2[C@@H](C(=O)[C@@]3([C@@]2(C=CC=C3)O)O)NC1=O
|
|
284
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
285
|
c1nc2nc(nc(n2n1)N)[O-]
|
|
286
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
287
|
CN(C)S(=O)(=O)n1cccn1
|
|
288
|
c1cc2c(nc1)[C@@H](O[C@@H]2O)O
|
|
289
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
290
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
291
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
292
|
c1ccc(cc1)c2ccccn2
|
|
293
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
294
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
295
|
c1cc([nH]c1)C(=O)c2ccc[nH]2
|
|
296
|
c1cc(cnc1)NCc2csnn2
|
|
297
|
COC1=CC(=O)O[C@@H](C1)C2CCCO2
|
|
298
|
Cc1ccc(o1)SCc2ccco2
|
|
299
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
300
|
c1ccnc(c1)/N=C/C[C@@H](C(F)(F)F)O
|
|
301
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
302
|
c1ccc(cc1)COc2c(non2)N
|
|
303
|
Cc1nnc(s1)N2CCOC2=O
|
|
304
|
Cc1ccc2c(c1)N=C(C=C(N2)C)C
|
|
305
|
C1CCN(C(=O)C1)[C@@H]2C[C@@H]([C@@H](O2)CO)O
|
|
306
|
CC1(C=CN(C=C1)C(=O)C2=NC=CC2)C
|
|
307
|
CC(=O)c1ccc(c(c1)F)Sc2nncs2
|
|
308
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
309
|
c1ccc(cc1)C(=O)[C@H](C#N)C2=NCCC2
|
|
310
|
c1ccc(cc1)[C@H]2[C@@H]3CCCO[C@@H]3NC(=O)N2
|
|
311
|
c1cc2c(nc1)SCCN2
|
|
312
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
313
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
314
|
|
|
315
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
316
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
317
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
318
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
319
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
320
|
c1ccc(cc1)Nn2cncn2
|
|
321
|
C[C@@H](Cc1ccco1)NC(=O)C
|
|
322
|
COc1c2cc[nH]c2nc(n1)OC
|
|
323
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
324
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
325
|
Cc1c(sc(n1)C)c2nnc(o2)N
|
|
326
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
327
|
Cc1c(nc2ccccc2n1)c3cscn3
|
|
328
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
329
|
Cc1c(sc(n1)Cc2nc(cs2)O)C
|
|
330
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
331
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
332
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
333
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
334
|
c1cc(oc1)CNc2nnns2
|
|
335
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
336
|
c1ccc(cc1)[C@@H]2COC(=O)CN2
|
|
337
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
338
|
c1csc(n1)c2nccs2
|
|
339
|
c1cc(oc1)C(=O)/C=C/2C(=O)NCCN2
|
|
340
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
341
|
CN(C)C(=O)N[C@@H](C(Cl)(Cl)Cl)Nc1[nH]ncn1
|
|
342
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
343
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
344
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
345
|
c1cc2cccc3c2c(c1)NS3(=O)=O
|
|
346
|
CC[C@@]1(C(=N1)N(C)C)C2CCCCC2
|
|
347
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
348
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
349
|
|
|
350
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
351
|
Cc1c(sc(c1c2ccno2)SC)C#N
|
|
352
|
CC1=CC(=O)Nc2cncnc2N1
|
|
353
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
354
|
c1ccc(cc1)C2=NCCNC(=O)C2
|
|
355
|
c1cc(cc(c1)N)c2cocn2
|
|
356
|
c1ccc(cc1)OCc2[n-]nnn2
|
|
357
|
c1ccc2c(c1)NCCC(=N2)c3ccco3
|
|
358
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
359
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
360
|
c1ccc(cc1)CCc2csnn2
|
|
361
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
362
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
363
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
364
|
c1cc(oc1)COCCC#N
|
|
365
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
366
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
367
|
C1CCC2C(C1)NC3C(N2)NSN3
|
|
368
|
c1ccc(cc1)C[C@H]2C(=O)COC2=O
|
|
369
|
|
|
370
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
371
|
c1cc(nc2c1NC(=O)C2)F
|
|
372
|
[H]/N=c/nc(ss1)SCc2ccc(cc2)C(=O)OC
|
|
373
|
C1[C@@H](N2C=CC=NC2=NC1=O)C(=O)[O-]
|
|
374
|
c1ccc2c(c1)C[C@@H]2c3ccccn3
|
|
375
|
C1CCC(CC1)CC2=NCCNC2=O
|
|
376
|
CN(CCO)c1cnccn1
|
|
377
|
c1ncn(n1)Sn2cncn2
|
|
378
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
379
|
COC(=O)Cc1cccnn1
|
|
380
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
381
|
c1ccc(cc1)OCc2ccco2
|
|
382
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
383
|
CS(=O)(=O)Oc1ccccn1
|
|
384
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
385
|
|
|
386
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
387
|
CC(C)(C)C1CC2C(C(C1)C(=O)[O-])SOC2=O
|
|
388
|
C[C@@H]1CC=CCN(C1)S(=O)(=O)c2ccccn2
|
|
389
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
390
|
Cc1cc2[nH]nc(n2n1)c3ccccc3
|
|
391
|
C1C[C@H]2[C@@]34C[C@@H](N2C1)C=CC3=CC(=O)O4
|
|
392
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
393
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
394
|
c1cc(oc1)CNc2nccs2
|
|
395
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
396
|
c1(c(non1)N)c2nnc(o2)N
|
|
397
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
398
|
C=CCn1cc(ccc1=O)c2ccco2
|
|
399
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
400
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
401
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
402
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
403
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
404
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
405
|
|
|
406
|
C[C@@H]1NC2CCCCC2C(=O)O1
|
|
407
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
408
|
COc1cc(n[nH]c1=O)Cl
|
|
409
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
410
|
c1ccc-2c(c1)CCNc3c2cccc3
|
|
411
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
412
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
413
|
CC(=O)Nc1nnc(s1)c2c(non2)N
|
|
414
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
415
|
CCSc1ncnc(n1)N
|
|
416
|
[H]/N=c/n2c(c(s1)c3ccccc3)NCC2
|
|
417
|
CN1CCOc2c1cnn(c2=O)CCO
|
|
418
|
CC1=C(C(=O)OC1)c2c(ccc3c2oc(=O)cc3)OC
|
|
419
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
420
|
C1CC2C(CC1CL)C3C(C(=O)O2)OCCN3
|
|
421
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
422
|
CSc1nc(c(nn1)c2ccco2)c3ccco3
|
|
423
|
c1ccc(cc1)OC(=O)N2CC(=CC=C2)CO
|
|
424
|
|
|
425
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
426
|
CCCC(=O)/[NH+]=c/cc(c-2c(oc3ccccc3c2n1)O)C
|
|
427
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
428
|
C1CCC2C(C1)CC(S2)[C@@H](C3CCOC3)O
|
|
429
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
430
|
CSC1C2C3C(C(NNN3)CL)SC2NS1
|
|
431
|
C[C@@]1(c2cccn2-c3ccccc3CO1)C(=O)[O-]
|
|
432
|
CSc1c(c(c(s1)c2cc[nH]n2)c3ccco3)C#N
|
|
433
|
c1ccnc(c1)C2=CCCCC2
|
|
434
|
COC(=O)[C@@H](c1ccco1)N
|
|
435
|
c1cc(nn2c1ncc2)Cl
|
|
436
|
CN(c1cc(ccn1)C(F)(F)F)n2cccc2
|
|
437
|
COC(=O)CC1=NCCOC1=O
|
|
438
|
Cc1c(cn(n1)C)S(=O)(=O)n2cccn2
|
|
439
|
c1cc(oc1)/C=C/2CCC(=O)O2
|
|
440
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
441
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
442
|
c1cc(oc1)CSc2nccs2
|
|
443
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
444
|
C#CCSc1nn2cnnc2o1
|
|
445
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
446
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
447
|
CCn1c(c(nn1)C(=O)N)N
|
|
448
|
CCC(=O)OC/C=C/C=C/C
|
|
449
|
Cc1c(cccn1)C2=NCCC2
|
|
450
|
Cc1[nH]c(=O)c2c(n1)CCC2
|
|
451
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
452
|
c1ccc2c(c1)CCNC(=O)C(=O)N2
|
|
453
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
454
|
C[C@@H]1C(=N[C@@]2([C@@]1(c3ccccc3-c4c2cccc4)O)O)C
|
|
455
|
c1cc(oc1)c2nnc3n2nc(cc3)Cl
|
|
456
|
C1CCC2C(C1)NS(=O)(=O)CCO2
|
|
457
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
458
|
C=CCNc1nc(ns1)N
|
|
459
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
460
|
CCOC(=O)c1c(c2c(snc2s1)C)N
|
|
461
|
CC[C@H]1[C@H](C(=O)N1)NC(=O)OC
|
|
462
|
C=CCNC(=O)c1ccco1
|
|
463
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
464
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
465
|
CC1=NS(=O)(=O)NC2=C1CCCC2
|
|
466
|
c1ccc(cc1)c2ccncn2
|
|
467
|
Cc1c(n(c(=O)c(n1)C(=O)[O-])OCc2ccccc2)C
|
|
468
|
CCOc1c(o/c(=NC(=O)c2ccccc2)/s1)C(=O)OCC
|
|
469
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
470
|
Cc1ccc(n1c2c(c(c(o2)c3ccco3)c4ccco4)C#N)C
|
|
471
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
472
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
473
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
474
|
C1CCC2(C1)NC(CO2)(CO)CO
|
|
475
|
CCc1nc(cs1)CSc2nccn2C
|
|
476
|
C1C(SC(N1)N)[C@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
477
|
c1csc(n1)C(=O)CC#N
|
|
478
|
C1Cc2c(nn(c2N)CCC#N)C1
|
|
479
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
480
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
481
|
c1ccc-2c(c1)CNc3c2cccc3
|
|
482
|
C[C@@H](Cc1ccco1)NS(=O)(=O)C
|
|
483
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
484
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
485
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
486
|
Cc1c(nn(n1)C(=O)c2ccccc2)C
|
|
487
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
488
|
CCn1cc(cn1)[C@@H]2C[C@@H](N(S(=O)(=O)N2)C)C(=O)[O-]
|
|
489
|
c1c2c(cnc1Cl)CCN2
|
|
490
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
491
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
492
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
493
|
C1CCC2C(C1)C(=O)N3CCCC3[C@@H](N2)O
|
|
494
|
c1cc(cc(c1)C(F)(F)F)CSc2cn[nH]n2
|
|
495
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
496
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
497
|
C1CCC2C(C1)OC(=O)NS(=O)(=O)O2
|
|
498
|
CCn1cc(cn1)c2cc[nH]n2
|
|
499
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
500
|
CC(=O)OCc1ccccc1
|
|
501
|
C1NC(C2N1[C@@H]3[C@H]([C@@H]([C@@H](O3)CN2)O)O)C(=O)N
|
|
502
|
[H]/N=c/nc(ss1)Oc2ccccc2
|
|
503
|
Cn1ccnc1Oc2ccc(cc2)Cl
|
|
504
|
CCn1cc(cn1)c2ccno2
|
|
505
|
CC1=Nc2c(cccn2)NC(=O)C1
|
|
506
|
CC(=O)c1csc(n1)c2ccno2
|
|
507
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
508
|
Cc1c(oc(n1)S[C@@H](C)c2cccnc2)C
|
|
509
|
Cn1ccnc1NCc2ccco2
|
|
510
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
511
|
c1cc(oc1)S(=O)(=O)CC#N
|
|
512
|
c1cc(oc1)S(=O)(=O)N2CCOCC2
|
|
513
|
c1ccc-2c(c1)-c3cccc4c3c2ccc4
|
|
514
|
c1cc(oc1)C(=O)c2[nH+]c3c(n2[O-])CCCCC3
|
|
515
|
c1ccc(cc1)C(=O)c2ncco2
|
|
516
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
517
|
CC(=O)Nc1ccc2c(c1)ccs2
|
|
518
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
519
|
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C
|
|
520
|
CSc1nnc2n1[nH]cn2
|
|
521
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
522
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
523
|
Cc1cc(no1)C(=O)N=[S@@](=O)(C)c2ccccc2
|
|
524
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
525
|
Cc1c2c(c(=O)n(nn2)CC(=O)NC)n(n1)C
|
|
526
|
c1cc(c(nc1)c2ccco2)N
|
|
527
|
CC1CCC2C3C1[C@@H]([C@@H]([C@@H]3CCS2)C(=O)N)O
|
|
528
|
c1ccc(cc1)c2c3c(c4ccccc4o3)[nH]n2
|
|
529
|
c1cnc2c(n1)c(cs2)N
|
|
530
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
531
|
C[C@@H]1CN/C(=C/C(=O)CC(C)C)/C(=O)N1
|
|
532
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
533
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
534
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
535
|
CC1NCC(N1CC2CCCCC2)[C@@H](C3CCCO3)O
|
|
536
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
537
|
c1ccc2c(c1)Cc3c[nH]cc3C2
|
|
538
|
c1ccc(cc1)CNc2c(non2)O
|
|
539
|
c1ccc(cc1)NCn2cncn2
|
|
540
|
Cn1c(cc(n1)C(=O)OC)OC(=O)c2ccco2
|
|
541
|
C#Cc1cc2ccccc2nc1
|
|
542
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
543
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
544
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
545
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
546
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
547
|
CCSc1nc(c(c(=O)o1)C)O
|
|
548
|
c1ccc(cc1)c2nccnn2
|
|
549
|
Cc1cnc(o1)CN2CCc3c2cccc3
|
|
550
|
c1cc2c(nc1)NC(=O)CO2
|
|
551
|
Cc1nc(sn1)C2=CCCN(C2)C
|
|
552
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
553
|
Cn1c(cc(c1SC)c2ccco2)OC
|
|
554
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
555
|
c1cc(oc1)C(=O)N[C@@H]2CC(=O)c3c2ccs3
|
|
556
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
557
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
558
|
C1COC2=N[C@@H]3CCOC3=N[C@@H]21
|
|
559
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
560
|
CC(=O)N1CCO[C@@H]1c2c(c(c(s2)Cl)Cl)Cl
|
|
561
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
562
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
563
|
Cn1cnnc1SCC#C
|
|
564
|
c1ccn(c1)c2c(non2)N
|
|
565
|
c1cc(cnc1)C(=O)c2ccco2
|
|
566
|
C1CC1C(=CC(=O)[O-])C2CC2
|
|
567
|
CSc1cc(cs1)/C=Cc2cc(sc2)Cl
|
|
568
|
c1ccn(c1)c2ccsc2CO
|
|
569
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
570
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
571
|
CC[C@@]1(Cc2ccccc2O1)c3[nH]ccn3
|
|
572
|
C[C@@H]1NC(=O)c2ccccc2O1
|
|
573
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
574
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
575
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
576
|
c1ccnc(c1)CCS(=O)(=O)[O-]
|
|
577
|
c1ccc2c(c1)ncn2c3c(nns3)C(=O)N
|
|
578
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
579
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
580
|
CCOC(=O)c1c(=O)c2c(n3c1[NH2+]CC3)CCC2
|
|
581
|
c1ccc(cc1)C(=O)Cc2[nH]ccn2
|
|
582
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
583
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
584
|
CCOC(=O)[C@@H](C#N)C1=NCCC1
|
|
585
|
Cc1cc(n(n1)C)NS(=O)(=O)c2c(n(cn2)C)Cl
|
|
586
|
c1cc(oc1)CNn2cnnc2
|
|
587
|
CC(=O)NCC1CNCCN1
|
|
588
|
|
|
589
|
c1cc(oc1)c2nnc(s2)N
|
|
590
|
c1ccnc(c1)c2csc(n2)[O-]
|
|
591
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
592
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
593
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
594
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
595
|
c1cc(oc1)CNC(=O)n2ccnc2
|
|
596
|
CC(=O)OCc1c2n(nn1)CCC2
|
|
597
|
c1cnc(nc1c2nccs2)N
|
|
598
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
599
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
600
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
601
|
c1cnc(nc1)Sc2cnnc(c2Cl)[O-]
|
|
602
|
C([C@@H]1[C@@H]([C@@H]([C@@H](O1)O)O)O)O
|
|
603
|
CCS(=O)(=O)N1CC=C[C@@H]1C(=O)NC2CC2
|
|
604
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
605
|
CCC/C=C/COC(=O)N(C)C
|
|
606
|
CCOC(=O)C1=C(Oc2ccccc2NC1=O)N
|
|
607
|
c1ccc2c(c1)CCN(C2)C/C(=N/c3nccs3)/[O-]
|
|
608
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
609
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
610
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
611
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
612
|
c1ccc(cc1)[C@@H]2COC(=O)N2
|
|
613
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
614
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
615
|
c1ccc2c(c1)nc3n2[C@@H](NC(=[NH+]3)N)c4ccco4
|
|
616
|
c1nc([nH]n1)c2c(non2)N
|
|
617
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
618
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
619
|
Cc1[nH]c2c(n1)C(=O)CCC2
|
|
620
|
C1CC([NH]C1)C(=O)OCC#N
|
|
621
|
c1ccn(c1)c2nncs2
|
|
622
|
CC1(Cc2ccccc2/C(=C/C(=O)N)/C1)C
|
|
623
|
Cc1c(c(n[nH]1)C)[C@@H]2C[C@@H](C=C2)O
|
|
624
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
625
|
CCOC(=O)c1[nH]nc(n1)N
|
|
626
|
C1CCC2C(C1)-C3C(CCCN3)S2(=O)=O
|
|
627
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
628
|
Cc1c(cc/c(=NC(=O)C(C)C)/[nH]1)Br
|
|
629
|
Cc1[nH]c2cc(ccc2n1)F
|
|
630
|
c1ccc2c(c1)NC3(O2)CCCC3
|
|
631
|
c1cc(ccc1C(=O)c2nnc(s2)Cl)Cl
|
|
632
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
633
|
c1cc(sc1)C2=C(C(=O)OC2)c3cccs3
|
|
634
|
c1nnc(s1)SCC#N
|
|
635
|
CCOC(=O)Cc1coc(n1)C
|
|
636
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
637
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
638
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
639
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
640
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
641
|
Cc1cn2c(n1)sc(n2)NCC=C
|
|
642
|
c1ccc(cc1)NCc2cscn2
|
|
643
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
644
|
CC1=Cc2ccccc2C=C[C@@H]1O
|
|
645
|
c1cc(oc1)c2c(sc3c2c(c(s3)C#N)N)C#N
|
|
646
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
647
|
c1cc(oc1)c2cccs2
|
|
648
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
649
|
c1ccc2c(c1)C(=O)OCC(=O)N2
|
|
650
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
651
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
652
|
c1ccc(cc1)c2cscn2
|
|
653
|
c1nc2c(c(n1)[O-])nsc2C(=O)[O-]
|
|
654
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
655
|
CC(C)(C)OC(=O)N1Cc2cn[nH]c2C1
|
|
656
|
|
|
657
|
c1cc(cnc1)COC(=O)n2ccnc2
|
|
658
|
Cc1cnc(o1)COc2ccccc2
|
|
659
|
c1ccc(cc1)NC2=NCCCO2
|
|
660
|
CC(=O)Oc1c(ccs1)N
|
|
661
|
C1=CC=CC(C=C1)NC(=O)N
|
|
662
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
663
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
664
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
665
|
Cn1cccc1/C=C/2C(=NC(=O)N2)[O-]
|
|
666
|
c1ccc-2c(c1)NCc3n2ccc3
|
|
667
|
CC(=O)Nc1coc2c1cccc2
|
|
668
|
Cc1ccc(o1)[C@@H]2C[C@@H](n3c(ccn3)N2)C(F)(F)F
|
|
669
|
CCCC[C@@H](CC)C1=NCCO1
|
|
670
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
671
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
672
|
Cc1cccc(c1)NC2=NCCO2
|
|
673
|
CCn1c2ccccc2nc1c3csnn3
|
|
674
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
675
|
c1cc(oc1)c2nnc3n2CCCCC3
|
|
676
|
c1cnn2c1nc(cc2)Cl
|
|
677
|
c1c(cc(c2c1C=C(OC2)CO)O)O
|
|
678
|
CNC1C(=O)NC(SN1)SC2NC(=O)C(NS2)NC
|
|
679
|
c1ccc(cc1)n2cccc2c3ccsc3
|
|
680
|
Cc1nnc(s1)SCSc2ccccn2
|
|
681
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
682
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
683
|
c1ccc(cc1)Cn2ccnn2
|
|
684
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2cccs2
|
|
685
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
686
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
687
|
C[C@@H]1CN([C@@H](C2=C1N=CC2)C)C
|
|
688
|
CC1=C([C@@H]2C[C@](N1)(Oc3c2cccc3)C)C(=O)OC
|
|
689
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
690
|
CC(=O)c1c(c2ccccc2o1)n3cccc3
|
|
691
|
CC(=O)OC(C#C)OC(=O)C
|
|
692
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
693
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
694
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
695
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
696
|
c1cnc(cn1)Br
|
|
697
|
CCOc1cc(no1)Oc2ccccc2
|
|
698
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
699
|
Cn1c2c([nH]c1=O)nncn2
|
|
700
|
CS(=O)(=O)NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
701
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
702
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
703
|
CCCCOC1=N[C@@H]2[C@@H](CNC2=O)CO1
|
|
704
|
|
|
705
|
Cc1cc(c(nn1)N)C(=O)N
|
|
706
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
707
|
CN1NC(NN1)C2[N-]NNN2
|
|
708
|
CC(C)Oc1c(c(=O)c1=O)c2ccco2
|
|
709
|
CCOC=C(c1nnco1)c2nnco2
|
|
710
|
|
|
711
|
CC1=CC(=O)Nc2c(cccn2)O1
|
|
712
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
713
|
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)N1)C
|
|
714
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
715
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
716
|
c1ccc2c(c1)c(ccn2)c3cocn3
|
|
717
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
718
|
CN(C)c1nnnn1c2ncccn2
|
|
719
|
c1ccc(cc1)n2c(nnn2)n3c4ccccc4nn3
|
|
720
|
C=CCOC1CCNC(N1)N
|
|
721
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
722
|
c1ccc2c(c1)C(=NS2(=O)=O)n3ccnc3
|
|
723
|
Cc1csc(n1)c2c(nc3n2ccs3)C
|
|
724
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
725
|
c1ccc2c(c1)c3c(c(=O)o2)CNCO3
|
|
726
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
727
|
CCCCc1[nH]cc([nH+]1)CO
|
|
728
|
CCC(=O)Oc1c(noc1C)C
|
|
729
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
730
|
c1ccc2c(c1)NC=CN2CCO
|
|
731
|
Cc1c(nnn1c2ccsc2C(=O)OC)C(=O)C
|
|
732
|
C/C(=C/1C2CCCCC2NC1=O)/C3CCCO3
|
|
733
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
734
|
CC(=O)[C@@H]1O[C@@H]2C=C3CCC=CC3=C[C@@H]2O1
|
|
735
|
Cc1nnc(s1)[C@@H]2CCCN(C2)C(=O)C
|
|
736
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
737
|
CC(=O)Nc1c2cn[nH]c2ncn1
|
|
738
|
COc1c2c(ncn1)Sc3c(ncnc3OC)N2
|
|
739
|
CC(=O)O/C=C/c1ccccc1
|
|
740
|
c1cc(oc1)c2nc([nH]n2)N
|
|
741
|
c1ccc(cc1)c2c[nH]nc2c3ccc(cc3O)O
|
|
742
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
743
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
744
|
Cn1c2ccccc2c3c1c(=O)cc(o3)CO
|
|
745
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
746
|
Cc1nc(no1)Cn2c(=O)n(nn2)c3ccccc3
|
|
747
|
c1ccc2c(c1)NCCC(=O)N2
|
|
748
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
749
|
c1cc(c(nc1)c2ccsc2)N
|
|
750
|
Cc1cc(n(n1)C(=O)NC)C
|
|
751
|
CCOC(=O)[C@]1(N/C(=N/C)/O1)C(F)(F)F
|
|
752
|
|
|
753
|
c1ccc2c(c1)CN3CCCC3=[NH+]2
|
|
754
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
755
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
756
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
757
|
CC1=C(CC(=O)N1Cc2ccco2)C(=O)OC
|
|
758
|
CCNC(=O)c1csnn1
|
|
759
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
760
|
C[C@@H]1COC(=N1)c2cccs2
|
|
761
|
CC(=O)C(=C1Nc2ccccc2N1)C#N
|
|
762
|
c1ccc2c(c1)nc3n2CCC(=C3C(=O)Nc4ccccn4)[O-]
|
|
763
|
c1cc(sc1)C(=O)[C@@H]2CCC(=O)O2
|
|
764
|
c1ccc(cc1)/N=c/n(c(cs2)O)c3ccccc3
|
|
765
|
CN1CC(CN1)NC(=O)CCN2CCOC2=O
|
|
766
|
Cc1c(c(on1)C)Cn2ccccc2=O
|
|
767
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
768
|
CCO[S@@](=O)c1c(n2ccccc2n1)S(=O)(=O)[NH-]
|
|
769
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
770
|
CCc1nc(c2n1c(ccc2)C)N3CCCC3=O
|
|
771
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
772
|
C1COCCN1C2C(=O)NC(SN2)N
|
|
773
|
c1ccc2c(c1)-c3ccccc3[S@@](=O)O2
|
|
774
|
Cc1ccc(cc1)NS(=O)(=O)c2ccc(o2)Br
|
|
775
|
C1CCC2C(C1)OC[C@@H](CS2)O
|
|
776
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
777
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
778
|
CCN(CC)C#CN(CC)CC
|
|
779
|
c1c(nnn1CC(=O)[O-])CO
|
|
780
|
CCOC(=O)c1nc(on1)C
|
|
781
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
782
|
C1CCC2C(C1)-C3CNCNC3N=C(N2)N4CCCCC4
|
|
783
|
Cc1nccc(n1)Sc2ccccc2
|
|
784
|
CCC(=O)Oc1csc(n1)C
|
|
785
|
c1c(c2c(cn1)OCCN2)C#N
|
|
786
|
c1ccc2c(c1)[C@@H]3c4c([nH]c(=O)s4)SC=C3CO2
|
|
787
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
788
|
Cc1c(scn1)OC(=O)C
|
|
789
|
CC(C)C(=O)Nc1nc[nH]n1
|
|
790
|
c1ccc(cc1)CS(=O)(=O)n2ccnc2
|
|
791
|
CC(=O)O/C=C/CC(=O)OC
|
|
792
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
793
|
CC(=O)c1cn2c(n1)O[C@@](C2)(C)CO
|
|
794
|
CC=CCCC(/C1=COC(=O)C)(C)C
|
|
795
|
CC1(C=C(c2ccccc2O1)n3ccccc3=O)C
|
|
796
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
797
|
C1C(=O)CC2NN[NH]N2C1N
|
|
798
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
799
|
Cc1nc-2n(n1)Cc3c2cccc3
|
|
800
|
c1ccc(cc1)n2ncc(n2)c3[n-]nnn3
|
|
801
|
c1ccc(cc1)n2c(=O)cccn2
|
|
802
|
c1ccn(c1)c2nccs2
|
|
803
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
804
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
805
|
C1CCC(CC1)CC2CCC[NH]2
|
|
806
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
807
|
c1ccc2c(c1)c(ncn2)n3cncn3
|
|
808
|
c1ccnc(c1)CS(=O)(=O)[O-]
|
|
809
|
COC1=NC2=NCCN2C(=N1)OC
|
|
810
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
811
|
c1cc2c3c(c1)NC(=O)C4=C(N3CCC2)CCC4
|
|
812
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
813
|
CCN1CCC2C1NCNC2N
|
|
814
|
Cc1c2c(c(cn1)CO)COC(N2)(C)C
|
|
815
|
CNC(=O)Oc1ccccc1
|
|
816
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
817
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
818
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
819
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
820
|
CCOC(=O)C1=NOC(=O)[C@H]1C
|
|
821
|
c1ccc(cc1)C2=NC(=O)CN2
|
|
822
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
823
|
CNc1cnnc2c1cccc2
|
|
824
|
Cnccs/c1=NC(=O)c2ccc[nH]2
|
|
825
|
CC1=C(CCOC1)CC(=O)N
|
|
826
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
827
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
828
|
c1csc2c1S(=O)(=O)NCC2=O
|
|
829
|
c1ccc(cc1)c2cn3c(n2)scn3
|
|
830
|
|
|
831
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
832
|
[H]/N=c/n(ccs1)CC(=O)[O-]
|
|
833
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
834
|
c1cn(cn1)[C@@H]2CC([C@@H]3OC[C@H]2O3)(O)O
|
|
835
|
Cc1cc(no1)N[C@@]2(C(=O)[C@@H](C(=N2)C)C#N)C(F)(F)F
|
|
836
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
837
|
|
|
838
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
839
|
c1cc2c(nc1)nc(s2)Cl
|
|
840
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
841
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
842
|
c1ccc2c(c1)c(c3c(n2)C[C@@H]4CCCN3C4)C(=O)[O-]
|
|
843
|
CN(C)c1nc(=O)n2c(n1)OCC2
|
|
844
|
CC1=C(Nc2ccccc2NC1=O)C
|
|
845
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
846
|
c1cnccc1c2n[nH]c(=O)s2
|
|
847
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
848
|
Cc1ccc2c(c1)Nc3c(c(=O)c3=O)N2
|
|
849
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
850
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
851
|
CCOCC12COCN1COC2
|
|
852
|
c1ccc(cc1)Cn2cccn2
|
|
853
|
CCOC(=O)c1c(c([nH]n1)C)N
|
|
854
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
855
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
856
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
857
|
C[C@@H](Nc1nccs1)n2cncn2
|
|
858
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
859
|
COC(=O)CC1=C(NC(=NC1)N2CCCC2)O
|
|
860
|
Cc1cc(no1)Cn2cnc3ccccc3c2=O
|
|
861
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
862
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
863
|
c1cc2cccc3c2c(c1)C(=O)O3
|
|
864
|
CN1Cc2ccccc2NC1=O
|
|
865
|
COC(=O)NS(=O)(=O)OC
|
|
866
|
C/C(=C/C(=O)OC)/N1CCCC1
|
|
867
|
Cn1cc(cn1)NCc2ccco2
|
|
868
|
CSc1nc2c(c(n1)NCCCO)SCCC2
|
|
869
|
CC1(C=C(c2c1ccc(c2)C#N)n3ccccc3=O)C
|
|
870
|
c1ccc(cc1)c2cncnc2
|
|
871
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
872
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
873
|
c1ccc(cc1)S(=O)(=O)N2C=CC=CC=C2
|
|
874
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
875
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
876
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
877
|
c1nnc2n1nc3c(c2[O-])CCC3
|
|
878
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
879
|
Cc1ccc2c(n1)NCCC2=O
|
|
880
|
c1ccc2c(c1)nnn2C3=CCCO3
|
|
881
|
C[C@@H]1CCO[C@@H](C1)C=C(C)C
|
|
882
|
CN1CNC(=O)c2c1n[nH]n2
|
|
883
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
884
|
Cc1cc(n(n1)C(C)C)OC(=O)N(C)C
|
|
885
|
c1ccc(cc1)SCc2cnc(s2)Cl
|
|
886
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
887
|
Cc1c(n2c(c1C#N)NCC2)C
|
|
888
|
c1ccc(cc1)n2cccc2c3nc(nc(n3)Cl)Cl
|
|
889
|
c1cc(oc1)c2c(snn2)C(=O)[O-]
|
|
890
|
Cc1ccc(cc1)S(=O)(=O)Cn2cccc(c2=O)O
|
|
891
|
CCC/C=C/[C@@H](CC=C)OCC
|
|
892
|
c1ccc(cc1)[C@H]2[C@H]([C@H]3[C@@H](O2)CC(=O)O3)O
|
|
893
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
894
|
|
|
895
|
|
|
896
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
897
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
898
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
899
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
900
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
901
|
C=CC[C@@H]1CCCCC(=O)N1
|
|
902
|
C1[C@@H]([C@H](O[C@H]1[C@@H]2C=CC=NC2=O)CO)O
|
|
903
|
CN(C)C(=O)Sc1cccnc1
|
|
904
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
905
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
906
|
CC1=C(CCO1)C(=O)NCCO
|
|
907
|
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
|
|
908
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
909
|
c1c2c(sc1C(=O)[O-])CCOC2
|
|
910
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
911
|
CCCn1c(nnn1)Cn2cnc3ccccc3c2=O
|
|
912
|
C[C@@H]1CC(=O)Nc2c1c(nn2C)N
|
|
913
|
c1ccc2c(c1)c(c3c(n2)CCC3)n4cccn4
|
|
914
|
C1CCC(CC1)NSC2CCCCC2
|
|
915
|
CCOC(=O)/C=C/CCCc2c1cco2
|
|
916
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
917
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
918
|
c1c(non1)c2c(non2)N
|
|
919
|
Cc1cc(n(n1)Cn2ccccc2=O)C
|
|
920
|
c1cc(oc1)OC(=O)[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
921
|
c1cc(nc2c1CNCC2)Cl
|
|
922
|
CS(=O)(=O)N1CCN(CC1)CN2CCOC2=O
|
|
923
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
924
|
C[C@@]1([C@@H]2CCCN2C(=O)O1)CO
|
|
925
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
926
|
c1ccc-2c(c1)CCc3c2nns3
|
|
927
|
CCOC(=O)Cn1nnnn1
|
|
928
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
929
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
930
|
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)[O-])c2ccco2
|
|
931
|
Cc1cnc(nc1c2ncnn2C)N
|
|
932
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
933
|
CC(C)C(=C=C(C)OC(=O)C)C
|
|
934
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
935
|
Cc1[nH]c2c3ccccc3sc2n1
|
|
936
|
c1ccc(cc1)CNc2cnoc2
|
|
937
|
C1CC(CCC=C1)CCC(=O)N
|
|
938
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
939
|
Cc1ccc2c(c1)nnc(n2)N
|
|
940
|
Cc1ccc2c(c1)c(c3n2C[C@H]4CO[C@@]3(O4)C)C
|
|
941
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
942
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
943
|
c1ccc(cc1)C2=NS(=O)(=O)Nc3c2cccc3
|
|
944
|
Cc1cc(no1)CSc2nncs2
|
|
945
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
946
|
C1CC(CCC1NC(=O)C2=C([C@@H]3C=C[C@H]2O3)C(=O)[O-])CL
|
|
947
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
948
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
949
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
950
|
Cn1cccc1c2csc(n2)c3ccco3
|
|
951
|
CC(=O)Oc1coc2c1cccc2
|
|
952
|
c1cc(cnc1)c2nnc(s2)Cc3cccs3
|
|
953
|
Cc1nc2c(nc(=O)n(c2s1)CC(=O)N)c3cccs3
|
|
954
|
c1nncn1NC(=O)CC#N
|
|
955
|
CC(=O)OC/C=C/c1cccnc1
|
|
956
|
CCc1cccc([o+]1)c2ccccc2
|
|
957
|
c1c(c(n(n1)C(=O)CCN2CCOC2=O)N)C#N
|
|
958
|
C1NC2N(N1)[C@@H]3C[C@](N2)([C@H]4OC[C@@H]3O4)O
|
|
959
|
c1ccc2c(c1)CC[NH+]=C2c3ccco3
|
|
960
|
Cc1ccc(cc1)c2cnon2
|
|
961
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
962
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
963
|
Cc1ccccc1SCCN2CCOC2=O
|
|
964
|
|
|
965
|
Cc1cc(ncn1)Nc2ccccc2
|
|
966
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
967
|
c1ccc2c(c1)cc(c(=O)o2)C(=O)n3cccn3
|
|
968
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
969
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
970
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
971
|
CC(C)C(=O)Nc1ccon1
|
|
972
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
973
|
CC(=O)NCc1ccccn1
|
|
974
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
975
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
976
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
977
|
c1cc(sc1)c2cc(c(nn2)O)NC(=O)C3CCC3
|
|
978
|
Cc1c(oc(n1)Cn2nc(nn2)c3ccccc3)C
|
|
979
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
980
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
981
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
982
|
CC1=C/C(=C/2C=CC=CC2=O)/N=C(N1)N
|
|
983
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
984
|
CCCc1nc2c(o1)cccn2
|
|
985
|
[H]/N=c/n2c(c(cnc2nn1c3ccccc3)O)C
|
|
986
|
c1ccn(c1)C(=O)[C@@H]2CC(=O)OC2
|
|
987
|
c1cc(sc1)CC(=O)n2cnnc2
|
|
988
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
989
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
990
|
C1CC(C1)c2nc(no2)CO
|
|
991
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
992
|
c1ccc2c(c1)ncn2n3cccc3
|
|
993
|
C1CCC2C(C1)C(NO2)C[S@@](=N)(=O)[O-]
|
|
994
|
CC(=O)NCCn1cccc1
|
|
995
|
c1ccc2c(c1)N[C@@H]3CC(=N2)[C@@H]4OC[C@H]3O4
|
|
996
|
Cc1nc-2c(s1)CCc3c2cccc3
|
|
997
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
998
|
CC1CC(N(N1)C2C3CCCCC3SN2)C
|
|
999
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
1000
|
CCCc1nncn1NC(=O)OCC
|
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