(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
2
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
3
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
4
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
5
|
c1c(nnn1CC(=O)[O-])CO
|
|
6
|
c1c2c(=O)[nH]c(nc2n[nH]1)[O-]
|
|
7
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
8
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
9
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
10
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
11
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
12
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
13
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
14
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
15
|
C1NC2C(C(N1)N)NCNC2N
|
|
16
|
c1nc2n(n1)C(=O)CC(=N2)[O-]
|
|
17
|
c1c(nc2nncn2c1[O-])[O-]
|
|
18
|
c1ccc(cc1)C#CCNc2[n-]nnn2
|
|
19
|
CNc1c(ncnn1)C(=O)[O-]
|
|
20
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
21
|
c1c(nc2cnnn2c1[O-])[O-]
|
|
22
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
23
|
C1CCn2c(nnn2)[C@@H](C1)C(=O)[O-]
|
|
24
|
CCCn1cnc(n1)NC(=O)c2cc(=O)n(c(n2)[O-])C
|
|
25
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
26
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
27
|
CCc1cnc([nH]1)NC(=O)OC(C)(C)C
|
|
28
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
29
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
30
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
31
|
Cc1cc(n2c(n1)ncn2)[O-]
|
|
32
|
Cc1cc(n2c(n1)nnn2)[O-]
|
|
33
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
34
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
35
|
Cn1c2c(c(=O)[nH]c1=O)non2
|
|
36
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
37
|
c12c(nnnc1snn2)O
|
|
38
|
C1C(=O)CC2NN[NH]N2C1N
|
|
39
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
40
|
[C@H]12[C@H]([C@@H]1C(=O)[O-])C(=O)N=C2[O-]
|
|
41
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
42
|
c1ccc(cc1)NC(=O)N/C=C/c2cccs2
|
|
43
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
44
|
CNC(=O)c1c2c(c(=O)oc1N)nns2
|
|
45
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
46
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
47
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
48
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
49
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
50
|
|
|
51
|
C1C2C(NC(N1)[O-])SNN2
|
|
52
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
53
|
C1CCC(CC1)/C=C/C=C/C2C(=O)[NH]C(=O)[NH]N2
|
|
54
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
55
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
56
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
57
|
c1nc2n(n1)[C@@H](C(=O)N2)CC(=O)[O-]
|
|
58
|
c1cc(cnc1)c2cc([nH]n2)NC(=O)c3cnns3
|
|
59
|
|
|
60
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
61
|
Cc1cc(c(nn1)N)C(=O)N
|
|
62
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
63
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
64
|
Cc1c2c(n[nH]1)COC(=O)N2
|
|
65
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
66
|
C1CC2C(C(N[NH]C2=O)[O-])C1
|
|
67
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
68
|
c1cc(ccc1/N=C(/Nc2[n-]nnn2)O)Cl
|
|
69
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
70
|
c1c(c(on1)C2CC2)C(=O)[O-]
|
|
71
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
72
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
73
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
74
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
75
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
76
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
77
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
78
|
CC(=O)Nc1nnc(s1)c2c(non2)N
|
|
79
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
80
|
c1coc2c1c(=O)[nH]nc2[O-]
|
|
81
|
C(COCCOCCO)O
|
|
82
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
83
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
84
|
CCOC(=O)Cn1nnnn1
|
|
85
|
CC[C@@H](CCC(=O)/N=c/ccn([nH]1)c2ccccc2)C(=O)[O-]
|
|
86
|
c1c([nH]nn1)SCC(=O)N
|
|
87
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
88
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
89
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
90
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
91
|
C1CS(=O)(=O)N[C@@H]1C(=O)[O-]
|
|
92
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
93
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
94
|
c1cc(cnc1)CCNCc2cscn2
|
|
95
|
CNC(=O)OCC#CCOC(=O)NC
|
|
96
|
CNC(=O)N/C=C/c1ccco1
|
|
97
|
C(CS(=O)(=O)N)NC(=O)N
|
|
98
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
99
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
100
|
C1C[C@@H]2C(=O)NCC(=O)N2C1
|
|
101
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
102
|
C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](N2C(=O)N1)O)O)O)O
|
|
103
|
c1cnoc1c2nnc(o2)N
|
|
104
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
105
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
106
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
107
|
|
|
108
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
109
|
c1c2nnnn2c(cn1)Cl
|
|
110
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
111
|
Cc1c2c([nH]n1)CCOC(=O)N2
|
|
112
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
113
|
C1Cn2c(=O)[nH]c(=O)nc2N1
|
|
114
|
CC1NNC2N1CC[NH]C2=O
|
|
115
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
116
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
117
|
CNc1c2c(nc(n1)N)non2
|
|
118
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
119
|
CC(C)(C)OC(=O)NCCc1nc2cnccc2o1
|
|
120
|
Cc1c2c(onc2c(=O)[nH]n1)C
|
|
121
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
122
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
123
|
c1c(n2c(n1)CCC2)C(=O)[O-]
|
|
124
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
125
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
126
|
Cc1nc(no1)CSc2nncs2
|
|
127
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
128
|
Cc1cc(nn2c1nnc2)O
|
|
129
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
130
|
c1ccc(cc1)OC(=O)Nc2csc(n2)Cc3ccsc3
|
|
131
|
CC(C)CN1N(O1)CCOC(=O)NC2CCCCC2
|
|
132
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
133
|
|
|
134
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
135
|
CC1=CC(=NS(=O)(=O)O1)[O-]
|
|
136
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
137
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
138
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
139
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
140
|
CN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)NC1=O)O
|
|
141
|
c1cc(ccc1Nc2nnc(nn2)NCCCO)Br
|
|
142
|
CN1C2C(CN1)C(NNN2)[O-]
|
|
143
|
CCOC1NNC(S1)CSC2CCCCN2
|
|
144
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
145
|
C[C@@H](C[S@@](=O)[O-])C(=O)[O-]
|
|
146
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
147
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
148
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
149
|
CCOc1nnc(s1)Cn2nc(nn2)c3ccccc3
|
|
150
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
151
|
c1c(non1)c2c(non2)N
|
|
152
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
153
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
154
|
c1cnc(=O)n2c1SCC2=O
|
|
155
|
CCSc1ccc(nn1)N
|
|
156
|
Cc1c(non1)c2ccn[nH]2
|
|
157
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
158
|
C1C[C@@H](OC1)COCCC#N
|
|
159
|
c1cc2c(c(c1N)N)non2
|
|
160
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
161
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
162
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
163
|
|
|
164
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
165
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
166
|
c1nc(c2c(n1)NCNS2(=O)=O)N
|
|
167
|
CC(C)Oc1cc(on1)C#N
|
|
168
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
169
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
170
|
c1nc2c(c(n1)[O-])nsc2C(=O)[O-]
|
|
171
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
172
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
173
|
c12c(=O)[nH]sc1snc2Cl
|
|
174
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
175
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
176
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
177
|
c1[nH]c(=O)c2c(n1)NCCC2
|
|
178
|
C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)N)O)O)O
|
|
179
|
CCn1c(nn(c1=O)C)C(=O)[O-]
|
|
180
|
C1CCc2c([nH]nc2O)CC1
|
|
181
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
182
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
183
|
c1c(=O)nc2n(n1)C(=O)CS2
|
|
184
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
185
|
Cn1c2c(cn1)nc[nH]c2=O
|
|
186
|
C1(=NS(=O)(=O)N=C1C(=O)[O-])C(=O)[O-]
|
|
187
|
CC1=CC(=O)O[C@@H]1CC(=O)[O-]
|
|
188
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
189
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
190
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
191
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
192
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
193
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
194
|
c1cc(oc1)c2nnc(s2)N
|
|
195
|
c1(c(n[nH]n1)C(=O)[O-])C(=O)[O-]
|
|
196
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
197
|
CC(=O)c1ccc(s1)C#N
|
|
198
|
Cc1nnc(s1)SCn2c3ccccc3nn2
|
|
199
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
200
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
201
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
202
|
C([C@@H]1[C@@H]([C@@H]([C@@H](O1)O)O)O)O
|
|
203
|
CN(C)c1nnc(o1)CC#N
|
|
204
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
205
|
CS(=O)(=O)NCCOc1ccccc1
|
|
206
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
207
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
208
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
209
|
CN1CNC2C1NNNC2[O-]
|
|
210
|
Cc1[n-]nc(n1)C(F)(F)F
|
|
211
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
212
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
213
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
214
|
Cc1cc(no1)CSc2nncs2
|
|
215
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
216
|
c1nc-2c3nc(on3cnc2n1)[O-]
|
|
217
|
c1nncn1NC(=O)CC#N
|
|
218
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
219
|
CCC(=O)Oc1csnn1
|
|
220
|
c1csc(n1)C(=O)CC#N
|
|
221
|
C(CCCOS(=O)(=O)N)CCCOS(=O)(=O)N
|
|
222
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
223
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
224
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
225
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
226
|
CCOc1nnc(s1)Cn2c(=O)c(c(c(n2)C)C)C#N
|
|
227
|
C(CNCC(F)(F)F)C#N
|
|
228
|
Cc1nc(on1)c2c(non2)N
|
|
229
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
230
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
231
|
CC(=O)Nc1cn(c(n1)C(=O)Nc2cn(c(n2)C(=O)[O-])C)C
|
|
232
|
c1cc(ccc1C(F)(F)F)Nc2c3ccncc3on2
|
|
233
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
234
|
C1S(=O)(=O)NC(=O)NS1(=O)=O
|
|
235
|
c1nc(no1)c2c(non2)N
|
|
236
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
237
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
238
|
C1NC([NH]N1)NC2=NCCO2
|
|
239
|
c1cc(ncc1C#N)NCc2nccs2
|
|
240
|
c1nc(nn1CC(=O)N)C#N
|
|
241
|
CCOC(=O)c1c([nH]c(=O)[nH]1)C
|
|
242
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
243
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
244
|
Cc1nc(no1)c2ncon2
|
|
245
|
c1cc(oc1)c2cc(no2)CO
|
|
246
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
247
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
248
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
249
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
250
|
Cn1c(c(c2c(c1=O)nns2)C#N)N
|
|
251
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
252
|
c1csc2c1ncnc2N
|
|
253
|
c1cc(cnc1)CNCCc2ccco2
|
|
254
|
c1cn(cn1)C(=O)OCC#N
|
|
255
|
CC(C)Oc1cc(on1)c2[n-]nnn2
|
|
256
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
257
|
c1cc(oc1)CNc2nnns2
|
|
258
|
CCn1c2c(con2)c(=O)[nH]c1=O
|
|
259
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
260
|
CCc1c(nnc(c1C#N)[O-])CC
|
|
261
|
Cc1nc2c(ncnc2o1)N
|
|
262
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
263
|
Cn1cc(nn1)NC(=O)c2ccc(cc2)Cn3cccc3
|
|
264
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
265
|
CCc1c(cccn1)C(=O)[O-]
|
|
266
|
C=CCCOCOCCC=C
|
|
267
|
c1ccc(cc1)NC(=O)OCc2cncs2
|
|
268
|
CSc1nc2ncnn2c(n1)[O-]
|
|
269
|
COC(=O)c1ncn(n1)CC#N
|
|
270
|
C1Cc2c(non2)C(=O)NC1
|
|
271
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
272
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
273
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
274
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
275
|
c1c[nH]c2c1c(ncc2)Cl
|
|
276
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
277
|
c1cc2c(c(c1)S(=O)(=O)N)non2
|
|
278
|
C1C[C@@H](OC1)C(=O)Nc2[n-]nnn2
|
|
279
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
280
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
281
|
c1(c(non1)N)c2nnc(o2)N
|
|
282
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
283
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
284
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
285
|
C(CC#CC(=O)N)CC#CC(=O)N
|
|
286
|
Cc1c2c(nnn2[O-])n(n1)C
|
|
287
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
288
|
C(CC#CC#CCCCO)CO
|
|
289
|
C1CNNCC1CCC(=O)[O-]
|
|
290
|
C1Cc2nnc(n2C1)C(=O)[O-]
|
|
291
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
292
|
C(C(=O)[O-])n1c(nnc1Cl)Cl
|
|
293
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
294
|
c1ccc(cc1)C2=NCC(=O)O2
|
|
295
|
c1nc2nc(nc(n2n1)N)[O-]
|
|
296
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
297
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
298
|
c1ccc2c(c1)C(=O)OCC(=O)N2
|
|
299
|
COC(=O)c1cc(=O)n2c(s1)ncn2
|
|
300
|
c1ccc(cc1)NC(=O)Nc2ccno2
|
|
301
|
C=CCNc1nc(ns1)N
|
|
302
|
C1CN2C=Nc3c(c(no3)C(=O)[O-])C2=N1
|
|
303
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
304
|
Cc1c(c(=O)[nH]c(n1)[O-])C#N
|
|
305
|
Cc1c2c(n3c(n1)nnn3)CCC2
|
|
306
|
Cn1c2c(c(ncn2)[O-])nn1
|
|
307
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
308
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
309
|
C1CCn2c(nnc2CC#N)C1
|
|
310
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
311
|
CC(=O)NCC1CNCCN1
|
|
312
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
313
|
C/C(=C/C(=O)[O-])/C(F)(F)F
|
|
314
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
315
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
316
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
317
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
318
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
319
|
CCNC(=O)c1csnn1
|
|
320
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
321
|
CCc1cnnn1c2c(non2)N
|
|
322
|
c1c(noc1N)C2CCCC2
|
|
323
|
c1nc([nH]n1)c2c(non2)N
|
|
324
|
Cn1c2c(cn1)NC(=O)NS2(=O)=O
|
|
325
|
COC1NCC(C(N1)[O-])C#N
|
|
326
|
Cc1c2sc(n1)NC(=O)N2
|
|
327
|
Cc1cc(cc2n1nnn2)O
|
|
328
|
c1ccc(cc1)Oc2cnns2
|
|
329
|
Cc1c(c(sn1)C(=O)[O-])N
|
|
330
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
331
|
CCS(=O)(=O)NCCn1cccn1
|
|
332
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
333
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
334
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
335
|
CCSc1cc(ncn1)N
|
|
336
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
337
|
CC(C)(C(=O)[O-])n1cncn1
|
|
338
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
339
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
340
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
341
|
Cc1nc(co1)/C=C(C)/CO
|
|
342
|
C(C#N)c1nc(nc(n1)N)N
|
|
343
|
CNc1c2c(nccn2)ncn1
|
|
344
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
345
|
c1cc(oc1C#CC(=O)[O-])Br
|
|
346
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
347
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
348
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
349
|
c1c(c2c(nc[nH]2)nn1)Cl
|
|
350
|
CC(=O)c1cc(cnc1)OC
|
|
351
|
CCOC(=O)NC#CNC(=O)OCC
|
|
352
|
c1c(nn[nH]1)SCc2nnc(n2N)CSc3cn[n-]n3
|
|
353
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
354
|
CC(=O)c1csc(n1)c2ccno2
|
|
355
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
356
|
c1ccc(cc1)NC(=O)/C=c/c(nc3n2ncn3)O
|
|
357
|
Cc1c(ccnc1COc2nc3ccccc3o2)OCC(C)C
|
|
358
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
359
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
360
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
361
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
362
|
c1ccc2c(c1)c3c(c(no3)N)c(=O)[nH]2
|
|
363
|
C(c1c(non1)N)c2c(non2)N
|
|
364
|
c1nc(c2c(ncn2n1)C#N)[O-]
|
|
365
|
c1cn2c(c1CO)[C@@H](CC2)O
|
|
366
|
C1Cc2c(non2)-c3c1non3
|
|
367
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
368
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
369
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
370
|
c1cc2c(nc1)n(nn2)[O+]=C(N)N
|
|
371
|
c1nc(nn1CCC#N)N=N=N
|
|
372
|
c1ccc(cc1)C(=O)Nc2nc3ccsc3s2
|
|
373
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
374
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
375
|
Cn1cccc1CNc2[n-]nnn2
|
|
376
|
COC(=O)c1ccc(o1)C#N
|
|
377
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
378
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
379
|
c1[nH]c(c(n1)C(=O)[O-])C(=O)[O-]
|
|
380
|
C1=N[C@@H]2[C@@H](N1)NC(=NC2=O)[NH-]
|
|
381
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
382
|
CCOc1cc(no1)Oc2ccccc2
|
|
383
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
384
|
Cc1c(non1)c2[n-]nnn2
|
|
385
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
386
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
387
|
CCCNC(=O)Cc1nc[nH]n1
|
|
388
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
389
|
CC(=C)c1nc(co1)C(=O)[O-]
|
|
390
|
CNc1cnnc2c1cccc2
|
|
391
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
392
|
c1ccc(cc1)CNc2ncco2
|
|
393
|
c1cc2c(c3c1non3)nns2
|
|
394
|
c1cc(sc1)CCNc2ncccn2
|
|
395
|
C1C=C[C@@H]([C@@H]2N1C(=O)OC2)O
|
|
396
|
CC1=Nn2c(nnc2N=C(C1)O)N
|
|
397
|
Cc1c(nc2c(n1)non2)[O-]
|
|
398
|
|
|
399
|
c1csc2c1c(ncn2)N
|
|
400
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
401
|
CS(=O)(=O)Nc1[n-]cnn1
|
|
402
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
403
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
404
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
405
|
c1(nnnn1O)c2nnnn2O
|
|
406
|
C=CCOCCOCCC#N
|
|
407
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
408
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
409
|
C1CCC(C1)c2nnc(o2)N
|
|
410
|
C[C@@]1([C@@H]2CCCN2C(=O)O1)CO
|
|
411
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
412
|
c1cc2c(cc1N)SCN2
|
|
413
|
CN1CC(CN1)NC(=O)CCN2CCOC2=O
|
|
414
|
C1C=C2C(=C[C@@]1(CCO)N)OCO2
|
|
415
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
416
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
417
|
|
|
418
|
CC1(COC(=O)C(=C1C(=O)[O-])C(=O)[O-])C
|
|
419
|
C1CCc2c(nc(nn2)N)C1
|
|
420
|
c1ccc2c(c1)nc(o2)C3=CNc4ccccc4N=C3
|
|
421
|
c1c(cnnc1[O-])C(F)(F)F
|
|
422
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
423
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
424
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
425
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
426
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
427
|
Cc1coc2c1c(=O)[nH]cn2
|
|
428
|
Cc1csc(n1)c2cn[nH]c2N
|
|
429
|
CC[C@H]1[C@H](C(=O)N1)NC(=O)OC
|
|
430
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
431
|
CO/C(=N/c1nncs1)/[O-]
|
|
432
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
433
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
434
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
435
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
436
|
c1cc2c(c(c1)S(=O)(=O)[O-])nn[nH]2
|
|
437
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
438
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
439
|
CC1(CNC(=O)C2=C(O1)C(=O)OC2)C
|
|
440
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
441
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
442
|
c1ccc(cc1)n2c(c(nn2)c3nc4ccccc4s3)N
|
|
443
|
c1c2c(nc(n1)N)CCOC2
|
|
444
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
445
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
446
|
c1ccc2c(c1)c(=O)[nH]c3n2nnc3
|
|
447
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
448
|
C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O)NC(=O)C)O
|
|
449
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
450
|
C[C@@H](C(=O)c1cn(nn1)c2ccc(cc2)C(=O)C)n3cncn3
|
|
451
|
c1cnn(c1)Cc2cnc(s2)Cl
|
|
452
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
453
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
454
|
CC(=O)OC/C=C/OC(=O)C
|
|
455
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
456
|
Cc1cc(no1)c2nnc(o2)N
|
|
457
|
[H]/N=c/n([nH+]c(s1)C)CC(=O)[O-]
|
|
458
|
CCCCc1[nH]cc([nH+]1)CO
|
|
459
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
460
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
461
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
462
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
463
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
464
|
c1csc2c1[nH]c(=O)oc2=O
|
|
465
|
Cn1c(nnn1)I
|
|
466
|
c1ccc(cc1)[C@@H]2CCC(=O)O2
|
|
467
|
C1CCC(CC1)SC2[N-]NNN2
|
|
468
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
469
|
c1ccc(cc1)Oc2c(non2)N
|
|
470
|
C1C[C@@H](Cc2c1snn2)C(=O)[O-]
|
|
471
|
c1cc(cnc1)CS(=O)(=O)N
|
|
472
|
CCSC1C2C(CN[NH]2)NCN1
|
|
473
|
c1c(cn[nH]1)CS(=O)(=O)N
|
|
474
|
Cn1cnc2c1S(=O)(=O)NCN2
|
|
475
|
c1nnc2n1NC(=O)CCS2
|
|
476
|
CC(C)(C)OC(=O)N1CCC(CC1)Oc2ccc(=O)[nH]n2
|
|
477
|
c1c[nH]c2c1c(cnc2)Cl
|
|
478
|
c1cnc(cn1)c2nnc(o2)N
|
|
479
|
CCOC(=O)[C@@H]1COC(=N1)C
|
|
480
|
Cncc([nH]/c1=NC(=O)Nc2ccc(cc2)O)[O-]
|
|
481
|
c1cc2c(cc1N)NCC[NH2+]2
|
|
482
|
C(#N)c1c(c2c(nc1N)non2)N
|
|
483
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
484
|
c1cc(oc1)c2nc(on2)CO
|
|
485
|
CC1CCCC(N1)C2[N-]NNN2
|
|
486
|
Cc1c(nn2c(n1)nnn2)C
|
|
487
|
C[C@@H]1Cc2c(cn[nH]2)C(=O)C1
|
|
488
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
489
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
490
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
491
|
c1cocc1c2nc([nH]n2)N
|
|
492
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
493
|
|
|
494
|
COc1c2cn[nH]c2ncn1
|
|
495
|
|
|
496
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
497
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
498
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
499
|
CS(=O)(=O)Nn1cnnc1
|
|
500
|
c1cc(c2nncn2c1)Cl
|
|
501
|
COC(=O)Cc1cccnn1
|
|
502
|
c1c(c2c(s1)nns2)C#N
|
|
503
|
c1cc2c(c(c1)F)c(no2)N
|
|
504
|
C=CCOc1ccc(cc1)O
|
|
505
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
506
|
|
|
507
|
CSc1c(c([nH]n1)N)C#N
|
|
508
|
CC1C(CN2C1C(=O)[NH]CN2)[O-]
|
|
509
|
CC(C)(C#Cc1nnn(n1)C)O
|
|
510
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
511
|
c1cc(cc(c1)Cl)c2nnn(n2)c3ccc4nnnn4n3
|
|
512
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
513
|
CCOc1nnc(s1)CN2CCOCC2
|
|
514
|
Cc1c2c(on1)CCOC(=O)N2
|
|
515
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
516
|
c1nc2c(s1)c(=O)[nH][nH]c2=O
|
|
517
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
518
|
[H]/N=c/n(ccs1)CC(=O)[O-]
|
|
519
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
520
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
521
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
522
|
Cc1nc2cccc3c2n1CCN3
|
|
523
|
COC(=O)c1cc(=O)nc(s1)N
|
|
524
|
Cc1c(nnc(c1c2[n-]nnn2)[O-])C
|
|
525
|
CCC(=O)N/C=C/c1ccccc1
|
|
526
|
c1(nnc(s1)S(=O)(=O)[NH-])N
|
|
527
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
528
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
529
|
C1CC1C(=CC(=O)[O-])C2CC2
|
|
530
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
531
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
532
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
533
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
534
|
CC1NC(ON1)C2CCCS2
|
|
535
|
Cc1c2cnnc(c2c([nH]1)C)[O-]
|
|
536
|
CC1NC(ON1)CC2CCCS2
|
|
537
|
c1nnn(n1)C[C@@H]2CCOCO2
|
|
538
|
c1ccc(cc1)c2cs/c(=N/C(=O)c3ccc(cc3)F)/o2
|
|
539
|
c1c[nH]c(=O)c2c1scc2
|
|
540
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
541
|
c1cc(sc1)NC(=O)NCC2CC2
|
|
542
|
c1ccc(cc1)C2=CCC(=O)O2
|
|
543
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
544
|
c1ccc(cc1)[C@@]2(C=C(C(=O)O2)O)O
|
|
545
|
Cc1c(c(n[nH]1)C)NC(=O)C
|
|
546
|
CCOC(=O)c1nccnn1
|
|
547
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
548
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
549
|
CC1=Nc2c(non2)N=C(C1)C
|
|
550
|
CSc1nnc(o1)Cn2cnc(c2Cl)Cl
|
|
551
|
Cc1c(oc(n1)SCC(=O)[O-])C
|
|
552
|
C[C@H]1OC[C@@H]([C@@H](O1)/C=C/C(=C/C(=O)OC)/C)O
|
|
553
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
554
|
CC[C@@](C)(c1nnn(n1)C)O
|
|
555
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
556
|
|
|
557
|
c1cc(oc1)COCCC#N
|
|
558
|
Cc1ccnc(c1)Nc2ccc(nn2)NCCNC(=O)C
|
|
559
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
560
|
CC(=O)c1cc2c(cco2)nc1
|
|
561
|
Cc1nc(on1)C2CN(C2)C(=O)C
|
|
562
|
c1ccc2c(c1)C(=O)N=[S@]2(=O)O
|
|
563
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
564
|
c1ccc(cc1)COc2c(non2)N
|
|
565
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
566
|
Cc1c(sc(n1)C)c2nnc(o2)N
|
|
567
|
c1ccc(cc1)S(=O)(=O)Nc2nncs2
|
|
568
|
|
|
569
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
570
|
C1NC2N(N1)[C@@H]3C[C@](N2)([C@H]4OC[C@@H]3O4)O
|
|
571
|
C1CCC(CC1)NC(=O)NC2=CC=CN=CO2
|
|
572
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
573
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
574
|
c1c(c(on1)N2CCOCC2)C#N
|
|
575
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
576
|
Cc1c2cc(sc2nc3c1[nH]c(cc3=O)[O-])c4cccs4
|
|
577
|
CC12C(NC(=O)N1)NC(=O)N2
|
|
578
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
579
|
c1c(c2c(nncn2n1)[O-])Cl
|
|
580
|
CCOCCOCOCC=C
|
|
581
|
c1nnc2n1NC(=O)CS2
|
|
582
|
c1c2cc(oc2ncc1F)CO
|
|
583
|
c1cc(oc1)c2c(ncs2)C(=O)[O-]
|
|
584
|
CC1=C(CCC1(C)C)C(=O)[O-]
|
|
585
|
Cc1ccc(c(c1)c2cc(n[nH]2)C(=O)Nc3nnc(s3)C)O
|
|
586
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
587
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
588
|
c1ncn(n1)NCNn2cncn2
|
|
589
|
Cc1c(c(n[nH]1)n2ccnc2)N
|
|
590
|
COc1cnc(o1)C(=O)OC
|
|
591
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
592
|
CCC(=O)CC/C=C/C#CC#CC#CC
|
|
593
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
594
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
595
|
CCn1cc(cn1)c2ccno2
|
|
596
|
C(CCCC#N)CCCC#N
|
|
597
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
598
|
CC(=O)NCc1ccccn1
|
|
599
|
c1ccc(cc1)NC(=O)N[C@@H]2[C@@H](N=NS2)C(=O)[O-]
|
|
600
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
601
|
Cc1ccc(cc1)S(=O)(=O)Nn2nc(nn2)c3ccccc3
|
|
602
|
CC(C)(C#C)NC(=O)COC
|
|
603
|
c1cc2c(nc1)OCC(=O)N2
|
|
604
|
c1ccc(cc1)S(=O)(=O)Nc2ccon2
|
|
605
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
606
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
607
|
c1csc2c1S(=O)(=O)NC2=O
|
|
608
|
|
|
609
|
CCNC(=O)Oc1c2ccccc2on1
|
|
610
|
c1ccc(cc1)Cn2ccnn2
|
|
611
|
Cn1cnnc1S(=O)(=O)[O-]
|
|
612
|
c1csc2c1c(n[nH]c2=O)N
|
|
613
|
|
|
614
|
COC(=O)Cc1nnn(n1)CC(=O)c2ccc3c(c2)CCC3
|
|
615
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
616
|
CNC(=O)Oc1ccccc1
|
|
617
|
CSc1/c(=CN)/n2cnnc2n1
|
|
618
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
619
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
620
|
c1nc(c(n1CCO)N)C#N
|
|
621
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
622
|
Cc1c(cnc(n1)C)C(=O)C
|
|
623
|
C1COC(=CO1)c2nnc(o2)N
|
|
624
|
Cc1c(c(c2ncnn2n1)[O-])Cl
|
|
625
|
C1=CC=CC(C=C1)NC(=O)N
|
|
626
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
627
|
C1[C@H]2[C@H]3CO[C@@H]([C@@H]1NC(=O)N2)O3
|
|
628
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
629
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
630
|
C1[C@@]2([C@]1(C(=O)N=C2N)C#N)C#N
|
|
631
|
c1[nH]nc(n1)I
|
|
632
|
c1cn[nH]c1NC(=O)CC#N
|
|
633
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
634
|
c1ccc(cc1)OC(=O)Nc2c[nH]nc2
|
|
635
|
CN(C)c1nnnn1N(C)C
|
|
636
|
C1C[C@@H](OC1)c2nnc(o2)N
|
|
637
|
c1ccc2c(c1)C(=O)OS(=O)(=O)N2
|
|
638
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
639
|
C1Cc2c(nnc(c2C(F)(F)F)[O-])C1
|
|
640
|
C1CC([NH]C1)C(=O)OCC#N
|
|
641
|
c1csc2n1c(=O)[nH]c(=O)n2
|
|
642
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
643
|
c1cnc2c(n1)C(=O)NCN2
|
|
644
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
645
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
646
|
CN1C(=O)CNS1(=O)=O
|
|
647
|
C1COCCN1c2[n-]nnn2
|
|
648
|
CC(=O)NC1NCNC(N1)N
|
|
649
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
650
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
651
|
C1C2NC(=O)NC1NC(=O)N2
|
|
652
|
c1c(c2c(cn1)OCCN2)C#N
|
|
653
|
c1ccc(cc1)NC(=O)Nn2cncn2
|
|
654
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
655
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
656
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
657
|
c1ccc(cc1)n2cc(cn2)CSc3nncs3
|
|
658
|
c1ccc(cc1)[C@@H](c2c[nH]nc2)O
|
|
659
|
CCNC(=O)Cn1ccnc1
|
|
660
|
CCOc1c(c([nH]n1)N)C#N
|
|
661
|
CCSc1ncnc(n1)N
|
|
662
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
663
|
c1c2c(c3c(c1Br)non3)nno2
|
|
664
|
CC(=O)c1ccc(o1)C(=O)C
|
|
665
|
Cn1cc(nc1C(=O)[O-])NC(=O)c2cccs2
|
|
666
|
Cc1cc(no1)Cn2nc(nn2)c3ccccc3
|
|
667
|
CC(=O)c1cn2c(n1)O[C@@](C2)(C)CO
|
|
668
|
CC(=O)n1c(ncn1)SC
|
|
669
|
CCc1ccc(cn1)SC
|
|
670
|
CC1=COC(=O)c2ccccc2N1
|
|
671
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
672
|
C1C=C2C(=CC(=O)O2)[C@@H](O1)O
|
|
673
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
674
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
675
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
676
|
CN(C)C(=O)Nc1n[n-]nn1
|
|
677
|
Cn1c(=O)c2ccccc2nn1
|
|
678
|
CO[C@@H]1[C@H]2CC(=O)O[C@H]2CO1
|
|
679
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
680
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
681
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
682
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
683
|
COc1c2cc[nH]c2[nH]c(=O)n1
|
|
684
|
CCO[C@@H]1C(C(=NC(=O)N1)[O-])(F)F
|
|
685
|
COc1cccc(c1)c2nc(on2)Cc3cnc4ncnn4c3
|
|
686
|
Cn1c(=O)[nH]c(=O)n(c1=O)C
|
|
687
|
COC(=O)c1cccc2n1ncn2
|
|
688
|
|
|
689
|
c1cnn2c1N[C@H](CC2=O)CO
|
|
690
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
691
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
692
|
c1cc(oc1C(=O)[O-])S(=O)(=O)[O-]
|
|
693
|
c1ccc(cc1)Nn2cncn2
|
|
694
|
Cn1c(c(cn1)C#N)n2cccc2
|
|
695
|
c1nc(nn1CC(F)(F)F)N
|
|
696
|
c1nc2n(n1)C(=O)[C@@H](S2)CCO
|
|
697
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
698
|
CSC1NSC2N1C(NN2)N
|
|
699
|
C(CF)NC(=O)NCCF
|
|
700
|
CCOC(=O)c1nc(on1)C
|
|
701
|
CS(=O)(=O)NCc1ccco1
|
|
702
|
c1cc2c(c(c1)O)nnn2[O-]
|
|
703
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
704
|
[H]/N=c/1onc(s1)c2c(non2)N
|
|
705
|
c1ccc(cc1)n2cc(nc2)NC(=O)n3ccccc3=O
|
|
706
|
CC1=CO[C@@](CC1)(C)C(=O)[O-]
|
|
707
|
CC1C(NC2C(N1)C(NNC2N)N)C
|
|
708
|
C(#N)c1c(n[nH]n1)Br
|
|
709
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
710
|
c1([n-]nnn1)Nc2[n-]nnn2
|
|
711
|
c1c(sc(n1)Cl)S(=O)(=O)N
|
|
712
|
c1csc2c1c(=O)oc(=O)[nH]2
|
|
713
|
COC(=O)[C@@H]1CC2CNCN2C(=O)N1
|
|
714
|
Cc1ccc(cc1)c2nc(on2)c3cc4ccccc4[nH]3
|
|
715
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
716
|
CC1=C([C@@H](C1)C(=O)N)C(=O)N
|
|
717
|
CCCCc1cn(nn1)CC2CCN(CC2)C(=O)C
|
|
718
|
Cc1cc(nc2c1c(on2)N)C
|
|
719
|
CN1[C@H]2[C@@H](C(=O)N=C1[O-])N=C(N2)Cl
|
|
720
|
CCSc1nnc(s1)/N=C(/C2CCC2)[O-]
|
|
721
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
722
|
CCCCCC(=O)OCC#C
|
|
723
|
Cn1c(ccn1)c2nnc(o2)N
|
|
724
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
725
|
c1csc2c1NCCNC2=O
|
|
726
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
727
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
728
|
Cc1c(c(on1)C)S(=O)(=O)N
|
|
729
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
730
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
731
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
732
|
CCC(=O)Cc1cnccn1
|
|
733
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
734
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
735
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
736
|
Cc1nnc2n1C[C@@H](S2)C
|
|
737
|
CC1C(CCO1)S(=O)(=O)N
|
|
738
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
739
|
Cc1cc(no1)n2c(c[nH]c2=O)C
|
|
740
|
CS(=O)(=O)NCCOc1cc(ncn1)N2CCCC2
|
|
741
|
C[C@@]1(C(=N1)N(C)C)C(=O)OC
|
|
742
|
|
|
743
|
CCCNC(=O)Nc1c(c(c(o1)C)C)C#N
|
|
744
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
745
|
CCOc1nc(sn1)OCC
|
|
746
|
c1cc(oc1)S(=O)(=O)CC#N
|
|
747
|
C1CNC(=O)[C@@H]2[C@H]1CNC2=O
|
|
748
|
CC1C(NON1)C(=O)N(C)C
|
|
749
|
c1c(cn[nH]1)I
|
|
750
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
751
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
752
|
|
|
753
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
754
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
755
|
CCOC(=O)c1[nH]nc(n1)N
|
|
756
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
757
|
c1coc2c1C(=O)NCCC2
|
|
758
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
759
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
760
|
c1ccc(cc1)OCCn2ccnc2
|
|
761
|
Cc1ccc(o1)/C=C(C)/CO
|
|
762
|
c1c[nH]nc1C(=O)NC2CC2
|
|
763
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
764
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
765
|
C[C@@H](N1CCNC1)OCCCC2CCCCC2
|
|
766
|
C=CCNC(=O)n1ccnc1
|
|
767
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
768
|
CCCCCCC1CN[NH]N1
|
|
769
|
CCCCO[C@@H](C)n1cnnc1
|
|
770
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
771
|
C1(NNC(S1)CL)CL
|
|
772
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
773
|
CO[C@@H]1C=C[C@@H]([C@@H](O1)CO)O
|
|
774
|
CC1=CC(=NS(=O)(=O)N1)C
|
|
775
|
COc1cc(ccc1O)C#CC#CCN2CCCCC2
|
|
776
|
COc1ccc(cc1)c2nnc(o2)Sc3ccc4nnnn4n3
|
|
777
|
c1(c(sc(=O)s1)C(=O)N)C(=O)N
|
|
778
|
c1cc(sc1)c2c(n[n-]n2)C#N
|
|
779
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
780
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
781
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
782
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
783
|
C1CCC(C1)(C#N)NCCO
|
|
784
|
CN1C=C[C@@H]2[C@@H](C[C@@H]2C1=O)C#N
|
|
785
|
CNC(=O)NCNC(=O)NC
|
|
786
|
c1c(c(n[nH]1)n2cnnc2)N
|
|
787
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
788
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
789
|
COc1cc(n[nH]c1=O)Cl
|
|
790
|
Cc1c(cnn1C)CCc2nnc(o2)SC
|
|
791
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
792
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
793
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
794
|
CNC(=O)OCC(F)(F)F
|
|
795
|
c1ccc(cc1)Cn2cnnn2
|
|
796
|
c1cc(oc1)c2nc([nH]n2)N
|
|
797
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
798
|
c1cncc2c1c(cc(=O)o2)[O-]
|
|
799
|
|
|
800
|
COc1ccc(cc1)/C=C/c2nc3c(o2)C=CCC3
|
|
801
|
CNCC(=N/C1=NC(=O)Nc2ccc(cc2)O)[O-]
|
|
802
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
803
|
CC(C)(C)c1cnnc(n1)N
|
|
804
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
805
|
Cc1cc2n(n1)CCC(=O)N2
|
|
806
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
807
|
C1c2nnnn2Cc3n1nnn3
|
|
808
|
c1cc(sc1)c2[n-]nnn2
|
|
809
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
810
|
CS(=O)(=O)c1nc(on1)N
|
|
811
|
Cc1c(nnc(n1)SC)C
|
|
812
|
Cc1nc2n(n1)C(=O)C(=N2)[O-]
|
|
813
|
c1c(nn2c1OCCC2)CO
|
|
814
|
c1ccn2cc(nc2c1)CC#N
|
|
815
|
C[C@@H]1[C@@H](Nn2c(nnn2)N1)C
|
|
816
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
817
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
818
|
C1CCC(CC1)(O)O[S@@](=O)O
|
|
819
|
CN1C(NNN1)C(F)(F)F
|
|
820
|
Cc1ccc(cc1)NC(=O)[C@@H]2CC(=O)n3cnnc3N2
|
|
821
|
CC(=O)NC1CCCN2C1NNN2
|
|
822
|
Cc1ccc2c(c1)nnc(n2)N
|
|
823
|
Cc1cc(no1)c2c(c(no2)C)CO
|
|
824
|
c1c(csn1)S(=O)(=O)N
|
|
825
|
c1cc2c(nc1C#N)CCCN2
|
|
826
|
c1csc(c1n2cnnn2)C(=O)[O-]
|
|
827
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
828
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
829
|
c1c2c(n[nH]c1=O)CCOC2
|
|
830
|
Cc1c(=O)n2c(nn1)SCC(=N2)N
|
|
831
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
832
|
CCOC(=O)C=C1NCCN1
|
|
833
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4s3
|
|
834
|
c1ncn(n1)CCn2cncn2
|
|
835
|
CS(=O)(=O)NC[C@@H]1CCCO1
|
|
836
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
837
|
COc1c2cc[nH]c2nc(n1)OC
|
|
838
|
Cc1cc([nH]n1)OCCC#N
|
|
839
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
840
|
|
|
841
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
842
|
Cc1nn(c(=O)n1N)Cc2nnc(s2)Nc3ccccc3
|
|
843
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
844
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
845
|
C1[C@@H](C1(Cl)Cl)C(=O)[O-]
|
|
846
|
C=CCOc1cccnc1N
|
|
847
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
848
|
Cc1cc(=O)[nH]c(n1)C2CC2
|
|
849
|
c1nncn1c2[n-]c(nn2)N
|
|
850
|
CCCCC#C/C=C/COC(=O)C
|
|
851
|
c1ccc2c(c1)NS(=O)(=O)N2
|
|
852
|
c1cc([nH]c1)c2nnc(nn2)c3ccc[nH]3
|
|
853
|
c1c2c(nc(n1)N)CCCC2=O
|
|
854
|
Cn1c(nnn1)c2ccco2
|
|
855
|
c1c[nH]nc1C2CCCCC2
|
|
856
|
c1nnc(s1)NCCC#N
|
|
857
|
Cc1cc(n(n1)CCc2nc(on2)c3ccccc3)C
|
|
858
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
859
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
860
|
Cc1cc(c(nn1)C)SC
|
|
861
|
c1ccc(cc1)c2nnn(n2)n3nc(nn3)c4ccccc4
|
|
862
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
863
|
c1cc(oc1)[C@@H]2C[C@@H]2C(=O)[O-]
|
|
864
|
CC(=O)[C@@H](C1CCCCC1)O
|
|
865
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
866
|
c1cc([nH]c1)C(=O)c2ccco2
|
|
867
|
CCC(=O)OC/C=C/C=C/C
|
|
868
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
869
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
870
|
c1cc(oc1)CNc2nccs2
|
|
871
|
CC1(C(=O)N(C(=N1)O)CC(=O)[O-])C
|
|
872
|
c1cc2c(c(c1)Cl)[nH]nn2
|
|
873
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
874
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
875
|
c1(nnc(o1)[O-])C(F)(F)F
|
|
876
|
CCCC(=O)OCOC(=O)/C=C(C)/N
|
|
877
|
C=CCNc1cn[nH]c(=O)n1
|
|
878
|
c1cnc2c(n1)c(cs2)N
|
|
879
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
880
|
c1ccc(cc1)N2CCC(=O)C2
|
|
881
|
CC1=CC(=O)N=[S@@](=O)(O1)O
|
|
882
|
CCn1cc(cn1)c2cc[nH]n2
|
|
883
|
CCOc1c(nc(o1)C#N)C
|
|
884
|
C1COCCN1CCCN2C[C@@]34C[C@@H](O3)CC(=C4C2=O)C(=O)[O-]
|
|
885
|
c1cc2c(nc1)NC(=O)CO2
|
|
886
|
C1=NC2=NC=NC3=NC=NC(=N1)N23
|
|
887
|
c1cc2c(c3c1nncc3)non2
|
|
888
|
CN1[C@@H]2[C@@H](C(=NC1=O)[O-])N=C(N2)Cl
|
|
889
|
COc1ccc2nnnn2n1
|
|
890
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
891
|
CCOC(=O)c1c(onn1)C
|
|
892
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
893
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
894
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
895
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
896
|
Cc1[nH]c(=O)c2c(n1)CCC2
|
|
897
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
898
|
c1cc(nn2c1ncc2)Cl
|
|
899
|
CN(C)C(=O)Nc1[n-]nnn1
|
|
900
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
901
|
CCOC1NC(C(NN1)F)[O-]
|
|
902
|
Cc1cc2nc(nc(n2n1)N)N
|
|
903
|
Cc1c(c(n[nH]1)O)C2=NCCC2
|
|
904
|
CC(C)n1cc(cn1)C(=O)C
|
|
905
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
906
|
CC1=CNC(=O)CC(C1)(C)C
|
|
907
|
Cc1c2c(ncnc2on1)N
|
|
908
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
909
|
Cn1c2ccccc2n3c1n[nH]c3=O
|
|
910
|
Cc1nnc(c2n1c3ccoc3c2)[O-]
|
|
911
|
CCOC(=O)N/C=CNC(=O)OCC
|
|
912
|
c1cnn2c1nc(cc2)Cl
|
|
913
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
914
|
CC(C)(C)C(=O)OCSc1nc(no1)c2cccnc2
|
|
915
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
916
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
917
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
918
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
919
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
920
|
C1CNc2c(c(=O)c2=O)NC1
|
|
921
|
c1nc(nn1CCN2CCOC2=O)C#N
|
|
922
|
Cn1c2c(c(=O)n(c1=O)C)snn2
|
|
923
|
CC(C)c1nc([nH]n1)CC#N
|
|
924
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
925
|
CC(C)(C)N1C(=O)NCS1(=O)=O
|
|
926
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
927
|
|
|
928
|
C#CCSc1nn2cnnc2o1
|
|
929
|
c1ccc(cc1)c2nnc(o2)Cc3cn4ccsc4n3
|
|
930
|
c1cn[nH]c1c2ccsc2
|
|
931
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
932
|
CCO/C(=C/C1=NC(=O)[C@@](C1)(C(F)(F)F)[O-])/[O-]
|
|
933
|
CC(=O)c1ccc2nnnn2c1
|
|
934
|
CCOC1CCCC2N1CNN2
|
|
935
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
936
|
c1cc(sc1)n2c(nnn2)[O-]
|
|
937
|
c1cc2c(c3c1noc3)nco2
|
|
938
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
939
|
C1Cn2c(nnc2SC1)N
|
|
940
|
Cc1c(c2cnnc(n2n1)[O-])Br
|
|
941
|
Cc1c(scn1)OC(=O)C
|
|
942
|
|
|
943
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
944
|
C1CC(C1)c2nc(no2)CO
|
|
945
|
CC#CCCCCCCC#CC
|
|
946
|
c1ccc2c(c1)C3=NC(=N[C@H]3C2=O)C(=O)c4ccccc4C(=O)[O-]
|
|
947
|
CCOc1cc(c(o1)C)c2ccccc2
|
|
948
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
949
|
c1c(con1)I
|
|
950
|
c1cnoc1c2ccsc2
|
|
951
|
Cc1c[nH]/c(=NC(=O)OC(C)(C)C)/[nH]1
|
|
952
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
953
|
Cc1c2cc(ccc2[nH]n1)F
|
|
954
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
955
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
956
|
Cc1cc2c(c(=O)o1)[C@@H](CO2)O
|
|
957
|
c1cc(c2c(c1)ncs2)N
|
|
958
|
CC(C)(C)N(c1ccoc1)C(=O)[O-]
|
|
959
|
c1nnc(s1)SCC#N
|
|
960
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
961
|
CCOC(=O)[C@@H]1CC=C(C1)C
|
|
962
|
Cc1c2c(c(nn(c2=O)C)C)on1
|
|
963
|
C1CCC2C(C1)N[C@@H]3CCN2C3
|
|
964
|
Cc1c2ccccc2c(=O)on1
|
|
965
|
C1CC2(CC2)[C@@H]3[C@@H]1NC(=O)C3
|
|
966
|
C=CCOC1CCNC(N1)N
|
|
967
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
968
|
CC1NC2C(NCNC2NN1)N
|
|
969
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
970
|
c1cc(ccc1SCCCn2ccnc2)Cl
|
|
971
|
c1nc2n(n1)C[C@@H](CS2)O
|
|
972
|
c1c(c[nH]c1C(=O)[O-])S(=O)(=O)N
|
|
973
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
974
|
CN1NC(NN1)C2[N-]NNN2
|
|
975
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
976
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
977
|
c1cc(sc1)Cc2[n-]nnn2
|
|
978
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
979
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
980
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
981
|
C1[C@@H](NCC1(F)F)C(=O)N
|
|
982
|
Cc1nc(on1)CNC(=O)C
|
|
983
|
COC(=O)[C@@H]1[C@H]2C=CO[C@@H]2O1
|
|
984
|
c1cn2c(cc1=O)C(=O)NCC2
|
|
985
|
CC#CC1CCC(S1)C#CC#CC=C
|
|
986
|
COC(=O)NCNC(=O)OC
|
|
987
|
COc1ccc(s1)SC
|
|
988
|
Cc1c(c2c(o1)CCC2=O)C(=O)[O-]
|
|
989
|
c1cc(ccc1/C=Cc2ccnc(n2)Cn3cncn3)Cl
|
|
990
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
991
|
c1cn(cn1)Cc2cnc(s2)Cl
|
|
992
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
993
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
994
|
CC1=C[C@@H]2c3c(non3)C=CC2=N1
|
|
995
|
C1CNC2=NC(=O)CCN2C1
|
|
996
|
COCc1cn(nn1)[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
997
|
Cc1[nH]c(=O)c2c(n1)C[NH2+]C2
|
|
998
|
|
|
999
|
c1nc2c3n1CCN=C3NC=N2
|
|
1000
|
c1(=O)c(=O)c(c1Cl)Cl
|
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