(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
2
|
Cc1[nH]c2c3ccccc3sc2n1
|
|
3
|
CNC(=O)Nc1c2ccccc2nnn1
|
|
4
|
CC1[NH]C(=O)C(CN1)CC=C
|
|
5
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
6
|
c1c([nH]nn1)SCC(=O)N
|
|
7
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
8
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
9
|
Cn1cnnc1Cc2ccccc2
|
|
10
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
11
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
12
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
13
|
C1C(=O)CC2NN[NH]N2C1N
|
|
14
|
c1nnc2n1NC(=O)CCS2
|
|
15
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
16
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
17
|
C1C2=C[C@@H]3C=C[C@H]2[C@@H](C=C3)NC1=O
|
|
18
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
19
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
20
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
21
|
C1CCC(C1)c2nnc(o2)N
|
|
22
|
CC1=Nn2c(nnc2N=C(C1)O)N
|
|
23
|
Cc1[nH]c(c[nH+]1)c2ccnc(n2)SC
|
|
24
|
C1CCc2c([nH]nc2O)CC1
|
|
25
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
26
|
Cc1coc2c1c(=O)[nH]cn2
|
|
27
|
COC(=O)CCc1c[nH]cn1
|
|
28
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
29
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
30
|
c1ccc2c(c1)-c3c(c[nH]n3)CO2
|
|
31
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
32
|
c1cnccc1c2n[nH]c(=O)s2
|
|
33
|
C1[C@H]2[C@H]3CO[C@@H]([C@@H]1NC(=O)N2)O3
|
|
34
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
35
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
36
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
37
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
38
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
39
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
40
|
c1cc2c(c(c1)Cl)nc[nH]2
|
|
41
|
Cn1c2c([nH]c1=O)nncn2
|
|
42
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
43
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
44
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
45
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
46
|
Cc1c2ccc3c(c2oc(=O)c1Br)[nH]c(=O)o3
|
|
47
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
48
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
49
|
Cc1c(c(=O)[nH]c(n1)[O-])C#N
|
|
50
|
CCCCCCC1CN[NH]N1
|
|
51
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
52
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
53
|
c1ccc(cc1)Cc2ccn[nH]2
|
|
54
|
CC(=O)Nc1c2c(no1)CCC2
|
|
55
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
56
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
57
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
58
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
59
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
60
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
61
|
CC1CCC(N1N2C(NNN2)N)C
|
|
62
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
63
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
64
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
65
|
|
|
66
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
67
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
68
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
69
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
70
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
71
|
CCOc1nnc(s1)CN2CCOCC2
|
|
72
|
c1cc(n[nH]c1=O)NC2CC2
|
|
73
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
74
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
75
|
|
|
76
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
77
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
78
|
c1ccc2c(c1)c3c([nH]2)C=NCC3
|
|
79
|
C[C@@H]1Cc2c(c(=O)[nH]c(n2)N)N1Cc3ccncc3
|
|
80
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
81
|
c1c(noc1N)C2CCCC2
|
|
82
|
c1cc(cnc1)NCc2csnn2
|
|
83
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
84
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
85
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
86
|
c1c[nH]c2c1c(cnc2)Cl
|
|
87
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
88
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
89
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
90
|
Cc1ccc2c(c1)nnc(n2)N
|
|
91
|
C[C@@H]1CCCN(C1)C(=O)c2c(c(ns2)c3ccccn3)N
|
|
92
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
93
|
Cc1nnc(s1)NC2=NCCO2
|
|
94
|
C1CC2C(CC1BR)C3CCNC(C3[NH]2)C4=NCCC4
|
|
95
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
96
|
c1ccc(cc1)n2c3c(cn2)c(ncn3)N
|
|
97
|
C[C@@H]1C2=C(COC2=O)NC(=O)N1
|
|
98
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
99
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
100
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
101
|
Cc1c(non1)NS(=O)(=O)c2ccccc2
|
|
102
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
103
|
C1=CC=CC(C=C1)NC(=O)N
|
|
104
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
105
|
Cc1ncc-2n1Cc3c2cccc3
|
|
106
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
107
|
COc1ccc-2c(c1)CCc3c2onc3
|
|
108
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
109
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
110
|
c1cc2c(c(c1)F)c(no2)N
|
|
111
|
C=CCOC1CCNC(N1)N
|
|
112
|
c1cnccc1n2cc(cn2)N
|
|
113
|
c1ccc2c(c1)ccn2Cc3cnc(s3)Cl
|
|
114
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
115
|
c1cc2c(cc1Cn3cnnc3)OCO2
|
|
116
|
CC(=O)N[C@@H]1[C@@H]2CN3[C@H]1[C@H](O2)CC3
|
|
117
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
118
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
119
|
c1cc2c(cc1O)occ(c2=O)c3cnc[nH]3
|
|
120
|
Cc1cc(no1)CS(=O)(=O)NC
|
|
121
|
C1=C[C@H]2[C@H]3C=C[C@@H]([C@@H]1C(=O)N2)NC3=O
|
|
122
|
c1cc(oc1)c2ccnc(n2)N
|
|
123
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
124
|
|
|
125
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
126
|
C1C[C@@]2(CC(=O)OC2)CNC1=O
|
|
127
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
128
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
129
|
C1CCC(CC1)c2[n-]nnn2
|
|
130
|
c1cc(cc(c1)F)[N-]S(=O)(=O)c2cc(oc2)C(=O)N
|
|
131
|
COC(=O)Cc1cccnn1
|
|
132
|
C[C@@]1(C[C@@H](NC2N1NCN2)C3CCCCC3O)O
|
|
133
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
134
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
135
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
136
|
c1ccc(cc1)CCn2cnnn2
|
|
137
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
138
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
139
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
140
|
C=C1C=C(C(=O)Nc2ccccc2N1)O
|
|
141
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
142
|
c1cc2c(nc1)NC(=O)CO2
|
|
143
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
144
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
145
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
146
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
147
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
148
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
149
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
150
|
c1ccc(cc1)COc2c(nccn2)N
|
|
151
|
c1cc(nc(c1)F)c2cnc3n2ccnc3
|
|
152
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
153
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
154
|
CN1C(NCN1)CCC2CCCCC2
|
|
155
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
156
|
C[C@@H](c1ccnc(n1)N)Oc2ccccc2
|
|
157
|
CC(=O)Nc1c-2sscc2n(c1=O)C
|
|
158
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
159
|
C1COC(=CO1)c2nnc(o2)N
|
|
160
|
C=CCNC1CCNC(N1)N
|
|
161
|
C[C@@H]1[C@@H](NC2C(CNCN2)N1)C
|
|
162
|
c1csc2c1[nH]c(=O)oc2=O
|
|
163
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
164
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
165
|
c1ccc(cc1)Oc2c(non2)N
|
|
166
|
[H]/N=c/n(ccs1)CC(=O)[O-]
|
|
167
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
168
|
c1ccc2c(c1)Cn3c(cnn3)C=N2
|
|
169
|
c1c(cnnc1[O-])C(F)(F)F
|
|
170
|
Cc1c2c(on1)CCOC(=O)N2
|
|
171
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
172
|
Cc1c(c(no1)c2ccccc2)c3ccn[nH]3
|
|
173
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
174
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
175
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
176
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
177
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
178
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
179
|
|
|
180
|
C1[C@H]2[C@H]3CO[C@@H]([C@@]1(Nc4c(non4)N2)O)O3
|
|
181
|
c1c(c2c([nH]c1=O)CCC2)[O-]
|
|
182
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
183
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
184
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
185
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
186
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
187
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
188
|
C1C2NC(=O)NC1NC(=O)N2
|
|
189
|
Cc1cc(n2c(n1)nnn2)[O-]
|
|
190
|
c1cnnc2c1-c3c(non3)CC2
|
|
191
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
192
|
Cn1cc(cn1)c2ccncn2
|
|
193
|
c1cc(cnc1)CCNCc2cscn2
|
|
194
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
195
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
196
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
197
|
c1cc(oc1)CNc2nnns2
|
|
198
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
199
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
200
|
CC1(c2c([nH]c(=O)s2)Sc3c1sc(n3)[O-])C
|
|
201
|
c1cc2c(nc1C#N)CCCN2
|
|
202
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
203
|
CCOC(=O)Cc1[nH]ncn1
|
|
204
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
205
|
c1csc2c1cc([nH]2)C(=O)[O-]
|
|
206
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
207
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
208
|
c1cc(ccc1N)Sc2nncs2
|
|
209
|
c1cn(cn1)Cc2nnc(n2N)Cn3ccnc3
|
|
210
|
c1c[nH]c2c1sc(c2)C(=O)[O-]
|
|
211
|
c1ccc2c(c1)CS(=O)(=O)NC2=O
|
|
212
|
CN(C)c1ccnc(c1C#N)Nn2cnnc2
|
|
213
|
CCCc1nncn1NC(=O)OCC
|
|
214
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
215
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
216
|
c1cc(sc1)CCc2c(cco2)C(=O)[O-]
|
|
217
|
CCNC(=O)Oc1c2ccccc2on1
|
|
218
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
219
|
c1ccc(cc1)n2c3c(c(ncn3)[O-])nn2
|
|
220
|
C1Cn2c(nnc2SC1)N
|
|
221
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
222
|
c1ccc(cc1)CNc2c(non2)O
|
|
223
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
224
|
C[C@@H]1[C@@H](OCC(=O)N1)C2CCCCC2
|
|
225
|
C1CCC(CC1)[C@@H]2CCC(=O)N2
|
|
226
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
227
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
228
|
Cc1nccc(n1)Sc2ccccc2
|
|
229
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
230
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
231
|
c1cc(sc1)c2[n-]nnn2
|
|
232
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
233
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
234
|
Cc1[nH]c2c(n1)c(nnn2)N
|
|
235
|
c1cc(sc1)c2c(n[n-]n2)C#N
|
|
236
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
237
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
238
|
C1CCC(CC1)(O)O[S@@](=O)O
|
|
239
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
240
|
CC(=O)NCCc1coc2c1ccnc2
|
|
241
|
Cc1cc(c(s1)C)[C@@H]2C=CN=CN2
|
|
242
|
c1ccc(cc1)Nn2c3ccccc3nn2
|
|
243
|
C=CCOc1cccnc1N
|
|
244
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
245
|
CC1=NS(=O)(=O)c2ccccc2N1
|
|
246
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
247
|
CC1=CC(=O)O[C@@H]1Cc2ccncc2
|
|
248
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
249
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
250
|
Cc1cn(c2c1-c3c(cno3)CC2)C
|
|
251
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
252
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
253
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
254
|
c1cc(cnc1)[C@@H]2NC(CO2)(CO)CO
|
|
255
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
256
|
Cc1cnc(nc1c2ncnn2C)N
|
|
257
|
c1c[nH]c2c1cc3c(c2)OCO3
|
|
258
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
259
|
c1ccc2c(c1)CC(=C2)n3ccnc3
|
|
260
|
|
|
261
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
262
|
c1csc2c1NCCNC2=O
|
|
263
|
Cc1[nH]c(=O)c2c(n1)N=C(C[C@@H]2c3ccccc3)O
|
|
264
|
c1nnc2n1NC(=O)CS2
|
|
265
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
266
|
CC1C2C(C([NH]1)C3CCCCC3)NC(OC2=O)C
|
|
267
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
268
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
269
|
CC(C)(C)C1=CC=Nn2cnnc2S1
|
|
270
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
271
|
c1cnccc1[C@@H]2CCC=CC2
|
|
272
|
CN1Cc2ccccc2NC1=O
|
|
273
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
274
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
275
|
Cc1ccc(cc1)S(=O)(=O)N/C(=N/c2[nH]ncn2)/[O-]
|
|
276
|
|
|
277
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
278
|
c1ccc2c(c1)N(CCO2)C(=O)n3ccnc3
|
|
279
|
CC(=O)Nc1c2cn[nH]c2ncn1
|
|
280
|
c1ccc(cc1)Cn2c(c(nn2)C3=NCCO3)N
|
|
281
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
282
|
|
|
283
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
284
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
285
|
CC1CCC2C(C1)NNS2
|
|
286
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
287
|
c1cc(c2c(c1O)[C@@H]3CC[C@H]2C=C3)O
|
|
288
|
Cc1nc(c(o1)n2cnc3c2cccc3)C#N
|
|
289
|
Cc1cc2c(cc1nnc(c(nn2)N)N)C(C)C
|
|
290
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
291
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
292
|
C1CCC-2C(C1)-C3CCCC4C3C2CC(N4)CL
|
|
293
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
294
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
295
|
c1ccc2c(c1)[nH]c(n2)c3ccco3
|
|
296
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
297
|
Cc1nc(no1)Cn2cccc(c2=O)C(F)(F)F
|
|
298
|
c1cnc(cn1)NC2=NCCN2
|
|
299
|
C=c1/c(=C/c2ccccc2O)/c(=O)o[nH]1
|
|
300
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
301
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
302
|
CC1CN(C2C1-C3C(CN[NH]3)CC2)C
|
|
303
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
304
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
305
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
306
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
307
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
308
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
309
|
C1CCC(CC1)C2C(=O)OC(=O)[NH]N2
|
|
310
|
C(=C(C(F)(F)F)C(F)(F)F)NC(=O)N
|
|
311
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
312
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
|
313
|
CC12C(NC(=O)N1)NC(=O)N2
|
|
314
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
315
|
C1CC2C3C(C(NNN3)[O-])SC2NC1
|
|
316
|
c1cn[nH]c1c2ccsc2
|
|
317
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
318
|
c1ccc-2c(c1)CNC(=O)c3c2cccc3
|
|
319
|
CNC(=O)N/C=C/c1ccco1
|
|
320
|
CC1NCC2N1C=CN([C@@H]2O)C(=O)C
|
|
321
|
Cc1cc(nc2c1c([nH]n2)n3cccc3)C
|
|
322
|
C1CCC(C(C1)NC2[NH+]C(C(N2O)[O-])N)F
|
|
323
|
c1ncn(n1)C(=O)NC2CCCCC2
|
|
324
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
325
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
326
|
c1ccc2c(c1)-c3c(cn[nH]3)CC(=O)N2
|
|
327
|
Cc1c2c(c(no2)c3ccccc3)nc(n1)C
|
|
328
|
C1C#C/C=CC#CC[C@@H]([C@@H]1CO)CO
|
|
329
|
|
|
330
|
c1ccc(cc1)Cc2cnns2
|
|
331
|
CN(CC(=O)[O-])c1ncc2c(n1)C=CCC2
|
|
332
|
Cc1[nH]c(=O)c2c(n1)CCC2
|
|
333
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
334
|
COC1(c2c(non2)CC[C@@H]1O)OC
|
|
335
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
336
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
337
|
CN(C)c1nnnn1c2cccnc2
|
|
338
|
CCOC(=O)c1[nH]nc(n1)N
|
|
339
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
340
|
c1ccc(cc1)CNn2cnnn2
|
|
341
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
342
|
Cc1c(c2cnnc(n2n1)[O-])Br
|
|
343
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
344
|
c1ccc2c(c1)CNc3ccccc3O2
|
|
345
|
c1ccc-2c(c1)NCc3n2ccc3
|
|
346
|
|
|
347
|
c1cnc(nc1c2nccs2)N
|
|
348
|
Cc1ccc(cc1)n2cnnn2
|
|
349
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
350
|
Cc1c(c-2c(cn1)COc3c2cccc3)C#N
|
|
351
|
Cc1c(nc([nH]1)C=C)C(=O)C
|
|
352
|
c1cc(oc1)c2c[nH]c(=O)nc2N
|
|
353
|
C[C@@H]1CC(=O)Nc2c1c(nn2C)N
|
|
354
|
CC(=O)Nc1nc(sn1)Cl
|
|
355
|
c1nnc(s1)NCCC#N
|
|
356
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
357
|
Cc1c(c2nnn(n2n1)CCO)c3ccccc3
|
|
358
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
359
|
c1ccc(cc1)c2ccncn2
|
|
360
|
CC(=O)Nc1coc2c1cccc2
|
|
361
|
c1ccc(cc1)S(=O)(=O)Nn2cnnc2
|
|
362
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
363
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
364
|
CC1=C(Cc2c(c(=O)c2=O)C1)C
|
|
365
|
c1ccc(cc1)c2c3c(c(ncn3)[O-])sn2
|
|
366
|
C1CCC(CC1)CC2CCC[NH]2
|
|
367
|
CN1c2ccccc2C3(C1=O)[NH+]=c4ccccc4=[NH+]3
|
|
368
|
c1ccc(cc1)N2Cc3nc(=O)[nH]n3C2=O
|
|
369
|
Cc1cc(c(o1)C)c2cc[nH]n2
|
|
370
|
c1c(cn[nH]1)CS(=O)(=O)N
|
|
371
|
c1cc(n2c1c(ncn2)N)Br
|
|
372
|
C1CCC2(CC1)CNC(=O)O2
|
|
373
|
Cc1nnc(o1)CSc2nccn2C
|
|
374
|
c1cc(cnc1)c2[nH]cc([nH+]2)C3CCCCC3
|
|
375
|
CC(=O)[C@@H]1C[C@H]2CC[C@@H]1C=C2
|
|
376
|
Cn1c(=O)n(sc1=O)c2ccccc2
|
|
377
|
c1ccc(cc1)N2CC(=C(N)N)C(=NC2=O)[O-]
|
|
378
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
379
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
380
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
381
|
C(#N)c1c(c2c(c(sc2s1)C#N)N)N
|
|
382
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
383
|
c1ccc2c(c1)-c3c(snn3)C2=O
|
|
384
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
385
|
c1ccc(cc1)NC2=Nc3ccccc3CCC2
|
|
386
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
387
|
c1cc(oc1)c2csc3c2c(=O)[nH]cn3
|
|
388
|
c1ccc2c(c1)Cc3ccccc3NC2
|
|
389
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
390
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
391
|
CC1C2C(ON1)CSC3CCCCC3C2=O
|
|
392
|
CC1=CNC(=O)CC(C1)(C)C
|
|
393
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
394
|
CC(C)(C)OC(=O)[C@@H]1CN(C(=O)N1)C
|
|
395
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
396
|
c1csc2c1CCO[C@@H]2CC(=O)[O-]
|
|
397
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
398
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
399
|
c1ccc(cc1)Cn2ccnc2
|
|
400
|
c1cc2c(cc1F)c3c(cn2)nco3
|
|
401
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
402
|
c1c(c(n[nH]1)n2cnnc2)N
|
|
403
|
|
|
404
|
C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](N2C(=O)N1)O)O)O)O
|
|
405
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
406
|
CC(C)(C)c1ccc(=O)[nH]n1
|
|
407
|
Cc1cc2c([nH]1)ccc3c2non3
|
|
408
|
c1ccc(cc1)C2=C(C(=O)N3[C@@H]2CCC3)O
|
|
409
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
410
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
411
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
412
|
COC(=O)C[C@@H]1Cn2c(ncn2)N=C1O
|
|
413
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
414
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
415
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
416
|
c1c(cnc2c1COC(=O)N2)Br
|
|
417
|
c1cc(oc1)CNn2cnnc2
|
|
418
|
C[C@@H]1[C@@H](Nn2c(nnn2)N1)C
|
|
419
|
|
|
420
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
421
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
422
|
c1cnc(nc1c2cnccn2)N
|
|
423
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
424
|
Cc1cc(no1)c2c(c(no2)C)CO
|
|
425
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
426
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
427
|
Cc1cc(=O)oc-2c1C(=O)c3c2cccc3
|
|
428
|
CCC/N=c/c(=N/c2cccnc2)/c(c1O)O
|
|
429
|
c1cc(oc1)c2cc(=O)n3cnnc3s2
|
|
430
|
Cc1c(c2c(o1)CCC2=O)C(=O)[O-]
|
|
431
|
Cn1c(=O)cc([nH]1)c2ccccc2
|
|
432
|
c1ccc2c(c1)C[NH2+]C2=C(C#N)C#N
|
|
433
|
C1CC(CCC=C1)CCC(=O)N
|
|
434
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
435
|
CCSc1ncnc(n1)N
|
|
436
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
437
|
c1cc(cnc1)[C@@H]2c3cccn3CCN2
|
|
438
|
Cc1csc(n1)NC(=O)c2c(nns2)C
|
|
439
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
440
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
441
|
CCC(=O)Cc1cnccn1
|
|
442
|
c1cc(oc1)CNc2[n-]nnn2
|
|
443
|
c1csc2c1c(ncn2)N
|
|
444
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
445
|
CC1=C(CCOC1)CC(=O)N
|
|
446
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
447
|
c1ccc-2c(c1)CCCn3c2nnn3
|
|
448
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
449
|
c1c2c([nH]c(=O)c1C#N)CCOC2
|
|
450
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
451
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
452
|
c1ccc(cc1)SCc2cnc(s2)Cl
|
|
453
|
Cc1nc2nncn2c(n1)[O-]
|
|
454
|
c1cc2c(cc1Br)-n3c(noc3=O)CO2
|
|
455
|
c1ccc(cc1)C2=CCNn3cnnc3S2
|
|
456
|
C1CN[C@@](C(=O)N1)(C(F)(F)F)O
|
|
457
|
CS(=O)(=O)NCc1ccco1
|
|
458
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
459
|
Cc1c(cco1)c2nnc(o2)N
|
|
460
|
Cc1ccc(cc1)n2ccnc2
|
|
461
|
Cc1nc2c(s1)CN(CC2)S(=O)(=O)C
|
|
462
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
463
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
464
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
465
|
c1ccc(cc1)C(=O)[C@@H]2[C@H]3[C@@H]2C(=O)[C@@H]4OC[C@H]3O4
|
|
466
|
Cc1cc(nc(n1)SC)n2ccc(=O)[nH]c2=O
|
|
467
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
468
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
469
|
CC1CC(ON1)C(=O)C2CCCCC2
|
|
470
|
C1Cc2c(sc3c2c(c(c(=O)[nH]3)C#N)N)C1
|
|
471
|
CSc1/c(=CN)/n2cnnc2n1
|
|
472
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
473
|
COc1ccccc1n2ccnc(c2=O)N
|
|
474
|
C1CC2C(NC1)SC3CNNCC3N2
|
|
475
|
c1ccn(c1)Nc2ccncc2
|
|
476
|
c1cc(sc1)c2ccon2
|
|
477
|
Cc1cc(no1)c2ccccc2
|
|
478
|
|
|
479
|
Cc1c2cnn(c2c(nn1)[O-])C(C)(C)C
|
|
480
|
Cc1cc(nc(n1)N)Nn2cnnc2
|
|
481
|
C=CC[C@@H]1CCCCC(=O)N1
|
|
482
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
483
|
c1ccc(cc1)c2c3c(n[nH]2)CC[NH2+]C3
|
|
484
|
CC(C)n1c(=O)ccc2c1cnn2C
|
|
485
|
c1cc2c(nc1)OCC(=O)N2
|
|
486
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
487
|
Cc1cc(=O)[nH]c2c1CCO2
|
|
488
|
C1CCN(C1)c2c(=O)c(nsn2)Cl
|
|
489
|
c1ccc(c(c1)c2nnco2)O
|
|
490
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
491
|
c1csc(n1)n2cnnc2
|
|
492
|
C(C[C@@H]([C@@H](CO)O)O)CO
|
|
493
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
494
|
CCc1n[n-]/c(=N/C(=O)c2c(c(c(c(c2F)F)F)F)F)/s1
|
|
495
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
496
|
Cc1nnnn1[C@@H]2CC(=O)[C@H]3OC[C@@H]2O3
|
|
497
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
498
|
Cc1c2c([nH]n1)NC3=C([C@@H]2C)C(=O)OC3
|
|
499
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
500
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
501
|
C1CN2C=Nc3c(c(no3)C(=O)[O-])C2=N1
|
|
502
|
Cc1c2c(on1)CCCC2=O
|
|
503
|
C1CCC2C(C1)C3C([NH]2)C(=O)CCS3
|
|
504
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
505
|
Cc1ccoc1NC(=O)OC
|
|
506
|
c1csc2c1NC(=O)CCC2
|
|
507
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
508
|
CC1=C([C@@H](C1)C(=O)N)C(=O)N
|
|
509
|
CC(=O)c1cc2c(s1)SCC(=O)N2
|
|
510
|
CS(=O)(=O)NCc1ccccn1
|
|
511
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
512
|
CC1C(C(N[NH]1)C2CCON2)N
|
|
513
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
514
|
CSc1nccc(n1)c2cnoc2
|
|
515
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
516
|
CN1C2C(CN1)C(NNN2)[O-]
|
|
517
|
Cc1cc2cccc(c2o1)n3cnnn3
|
|
518
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
519
|
CC1(C(=O)N(C(=N1)O)CC(=O)[O-])C
|
|
520
|
c1cc(sc1)c2c[nH]nc2
|
|
521
|
Cc1cc2c3nnnn3cnc2s1
|
|
522
|
c1cc(ccc1C(=O)c2nnc(s2)Cl)Cl
|
|
523
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
524
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
525
|
CSc1c(c([nH]n1)N)C#N
|
|
526
|
c1(c(non1)N)c2nnc(o2)N
|
|
527
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
528
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
529
|
|
|
530
|
C1=C([NH2+]c2nnc(n2N=C1C(F)(F)F)N)[O-]
|
|
531
|
Cc1cc(c(nn1)N)C(=O)N
|
|
532
|
COc1c2c(ncn1)Sc3c(ncnc3OC)N2
|
|
533
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
534
|
CC(=O)Nn1c2ccccc2nn1
|
|
535
|
C/C=C/c1c2c(on1)C[C@@H](OC2=O)C
|
|
536
|
c1ccc2c(c1)Nc3c(sc(=O)[nH]3)C=N2
|
|
537
|
CCOC(=O)[C@@H]1c2c(c(c([nH]2)C)C)S[C@@H]1C
|
|
538
|
CCO/C=C/[C@@](CNC(=O)C1CC1)(C(F)(F)F)O
|
|
539
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
540
|
c1ccc-2c(c1)CCc3c2nns3
|
|
541
|
c1cc2c(cc1Cl)-c3c(c[nH]n3)CS2
|
|
542
|
Cn1cccc1/C=C/2C(=NC(=O)N2)[O-]
|
|
543
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
544
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
545
|
c1ccc2c(c1)c3c([nH]2)CCOC3
|
|
546
|
c1cnccc1c2nnc3n2CCC3
|
|
547
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
548
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
549
|
CCSC1C2C(CN[NH]2)NCN1
|
|
550
|
CC(C)N1C(NNN1)SC2CNN(C(=O)C2CL)C
|
|
551
|
c1ccc2c(c1)nc3n2C(=O)C3
|
|
552
|
c1csc2c1ncnc2N
|
|
553
|
|
|
554
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
555
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
556
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
557
|
CCSc1cc(ncn1)N
|
|
558
|
c1cc2c(nc1)NC3(N2)CCCCC3
|
|
559
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
560
|
c1cc(oc1)c2cc(no2)CO
|
|
561
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
562
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
563
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
564
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
565
|
C1CCC2C(C1)C[C@@H]3C[C@H]2OC3=O
|
|
566
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
567
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
568
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
569
|
CC(=O)[C@@H]1O[C@@H]2C=C3CCC=CC3=C[C@@H]2O1
|
|
570
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
571
|
CC1=Nc2c(ncn2N=C(C1)C)C#N
|
|
572
|
Cc1cc2n(c(c(s2)C(=O)C)[O-])c(=[NH2+])n1
|
|
573
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
574
|
CC1=CC(=O)Nc2ccccc2N1
|
|
575
|
CC1([C@H]2[C@@H]1[C@@H]3C=C[C@H]2O3)C(=O)OCC=C
|
|
576
|
COC(=O)c1cc2cc(oc2[nH]1)C#N
|
|
577
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
578
|
c1cc(sc1)C(=O)/C=C/2C(=O)NCCN2
|
|
579
|
CC1NC(ON1)C2CCCS2
|
|
580
|
Cc1csc(n1)c2cn[nH]c2N
|
|
581
|
c1c2n(nn1)CCn3c(cnn3)S2
|
|
582
|
c1cncc2c1sc(n2)Cl
|
|
583
|
c1cc(=O)oc2c1cc3c(c2O)OC=CC3
|
|
584
|
CCOc1cc(no1)Oc2ccccc2
|
|
585
|
C1CCn2c(nnc2CC#N)C1
|
|
586
|
CCN1CCC2C1NCNC2N
|
|
587
|
COC(=O)C[C@@]1(C(=C(C(=N1)[O-])N)C(=O)OC)C(=O)OC
|
|
588
|
c1cnnc2c1c(c(s2)C(=O)N)N
|
|
589
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
590
|
c1cncc2c1nc(o2)Cl
|
|
591
|
CNC1=N[C@@H]2CCCC[C@@H]2O1
|
|
592
|
Cn1c2c(cn1)NC(=O)NS2(=O)=O
|
|
593
|
c1c[nH]nc1C2CCCCC2
|
|
594
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
595
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
596
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
597
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
598
|
CN1[C@@H]2[C@@H](C(=NC1=O)[O-])N=C(N2)Cl
|
|
599
|
CC1NCC2C(N1)N=C(NC2)C3CCC(CC3)CL
|
|
600
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
601
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
602
|
C1CCC2C(C1)[C@@H]3CC[C@H]2NC3=O
|
|
603
|
CC(=O)[C@@H](C1CCCCC1)O
|
|
604
|
|
|
605
|
|
|
606
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
607
|
CCOC(=O)c1c([nH]n2c1nnc2C(F)F)C(F)(F)F
|
|
608
|
c1cn(cn1)C(=O)n2ccnc2
|
|
609
|
CC1NC(ON1)CC2CCCS2
|
|
610
|
CC(=O)C1=C(c2ccccc2S(=O)(=O)N1)[O-]
|
|
611
|
C=CCNc1cn[nH]c(=O)n1
|
|
612
|
c1cc2cn[nH]c2c(c1)S(=O)(=O)[O-]
|
|
613
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
614
|
CCOC(=O)[C@@]1(CC(=C)CO1)NC(=O)OC
|
|
615
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
616
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
617
|
CC(=O)NCc1ccccn1
|
|
618
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
619
|
C1CCC(CC1)SC2[N-]NNN2
|
|
620
|
c1cocc1/C=C/2C(=NC(=O)N2)[O-]
|
|
621
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
622
|
CC1=CC(=O)Nc2c(cccn2)O1
|
|
623
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
624
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
625
|
COC(=O)c1cc(=O)n2c(s1)ncn2
|
|
626
|
c1ccc(cc1)COn2ccnc2
|
|
627
|
c1ccc2=NC3=[NH+]CCN3C(=c2c1)[O-]
|
|
628
|
CC(C)C(=O)N1CCc2c(cnn2C)C1
|
|
629
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
630
|
|
|
631
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
632
|
c1ccc(cc1)[C@@H]2COC(=O)N2
|
|
633
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
634
|
CS(=O)(=O)Nc1ncccn1
|
|
635
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
636
|
CNC(=O)OCC(F)(F)F
|
|
637
|
C1=CN2[C@@H](N=C1)N=C3[C@@H](C2=O)NC=N3
|
|
638
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
639
|
Cc1cc2n(c(=O)c1C#N)CCO2
|
|
640
|
Cc1nnc2n1CCCCC2
|
|
641
|
Cc1cc(=O)oc2c1sc3c2cccc3
|
|
642
|
C1CNC(=O)[C@@H]2[C@H]1CNC2=O
|
|
643
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
644
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
645
|
CS(=O)(=O)NCc1cccs1
|
|
646
|
CNc1nnc(s1)Sc2nnc(s2)NC
|
|
647
|
Cc1c(c-2c(cn1)CCc3c2cccc3)C#N
|
|
648
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
649
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
650
|
CC(C)n1/c(=N/c2ccccc2)/c3ccccc3nn1
|
|
651
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
652
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
653
|
CCn1c(ccn1)C(=O)n2ccnc2C
|
|
654
|
c1ccc(cc1)/C/2=[NH+]/CCNC(=O)c3c2cccc3
|
|
655
|
C1CCC(CC1)C2CCNS2
|
|
656
|
|
|
657
|
c1cc2c(cc1N)SCN2
|
|
658
|
|
|
659
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
660
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
661
|
c1cc(sc1)c2nnco2
|
|
662
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
663
|
Cc1cc(n2c(n1)nnn2)c3ccccc3
|
|
664
|
c1ccc2c(c1)c3c([nH]2)CCC3
|
|
665
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
666
|
c1cc(sc1)[C@@H]2[C@@H](C(=NC(=O)N2)[O-])C#N
|
|
667
|
c1ccc(cc1)c2cn3c(n2)SCC(=O)N3
|
|
668
|
CC1=CO[C@@](CC1)(C)C(=O)[O-]
|
|
669
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
670
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
671
|
c1cc(cc(c1)N)CC(=O)[O-]
|
|
672
|
Cc1nc(c(o1)Sc2ccc(cc2)Cl)C#N
|
|
673
|
c1cc2c(cc1Cl)cc(o2)SCC(=O)[O-]
|
|
674
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
675
|
c1ncn(n1)CCn2cncn2
|
|
676
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
677
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
678
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
679
|
Cc1cc(=O)oc2c1c(n[nH]2)C
|
|
680
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
681
|
C1[C@@H]2[C@@H](C2(Cl)Cl)CC3=CC=CC=C1C3
|
|
682
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
683
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
684
|
CCC1C(=O)NCCNC1=O
|
|
685
|
c1cc(c2c(c1)SCc3ccsc3C2=O)N
|
|
686
|
Cc1cc(ncn1)SCc2csc(n2)C
|
|
687
|
CN1C(=O)C2C([NH]C1=O)S(=O)(=O)C3CCCCC3C2
|
|
688
|
Cn1cc(cn1)NCc2ccco2
|
|
689
|
c1ccc2c(c1)NS(=O)(=O)N2
|
|
690
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
691
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
692
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
693
|
CNc1ccc(cc1)C(=O)[O-]
|
|
694
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
695
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
696
|
c1cn(cn1)c2cc(=O)[nH]c(n2)N
|
|
697
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
698
|
COc1c(c(=O)c2c(s1)CCCC2)N
|
|
699
|
C1CCc2c([nH]c(=O)[nH]2)CC1
|
|
700
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
701
|
Cc1[nH]n(c2c(c(=O)c2=O)n(n1)C)C
|
|
702
|
CN1CNC2C1NNNC2[O-]
|
|
703
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
704
|
Cc1nc-2n(n1)CC(=Nc3c2cccc3)O
|
|
705
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
706
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
707
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
708
|
C1[C@@H]([C@H](O[C@H]1[C@@H]2C=CC=NC2=O)CO)O
|
|
709
|
|
|
710
|
C[C@@]12C[C@@H](c3ccccc3O1)NC(=O)N2C
|
|
711
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
712
|
c1cn2cc(nc2cn1)C(=O)[O-]
|
|
713
|
c1cc(sc1)CC(=O)n2cnnc2
|
|
714
|
C1CCN(C(=O)C1)[C@@H]2C[C@@H]([C@@H](O2)CO)O
|
|
715
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
716
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
717
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
718
|
c1nncn1NC(=O)CC#N
|
|
719
|
c1cc(cc2c1cc[nH]2)Cl
|
|
720
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
721
|
CN1C(=O)C(=C(C12CCCC2)N)C(=O)N
|
|
722
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
723
|
CS(=O)(=O)N[C@@H]1CCc2c1cccc2
|
|
724
|
c1cc(sc1)c2ccno2
|
|
725
|
c1cc(=O)n2n(c1=O)CN(C2)n3cnnc3
|
|
726
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
727
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
728
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
729
|
c1ccc(cc1)S(=O)(=O)Nc2ccon2
|
|
730
|
Cc1c2c(cc(c(=O)o2)NC(=O)C)c(cn1)CO
|
|
731
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
732
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
733
|
CN1C(=O)CC[C@@]1([C@@H]2CC=CC=C2)O
|
|
734
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
735
|
CC(=O)NC1NCNC(N1)N
|
|
736
|
Cn1c(ncn1)C(=O)C2CC2
|
|
737
|
Cc1[nH]c(cn1)C(F)(F)F
|
|
738
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
739
|
c1cc(oc(=O)c1)c2cccnc2
|
|
740
|
c1csc2c1c(ncn2)n3ccnc3
|
|
741
|
Cc1nc2c(cnn2c3ccccc3)c(=O)o1
|
|
742
|
c1ccc2c(c1)c(c(s2)NC(=O)O)C#N
|
|
743
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
744
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
745
|
Cc1c2sc(n1)NC(=O)N2
|
|
746
|
CNC(=O)OCC#CCOC(=O)NC
|
|
747
|
c1ccc(cc1)c2cnccn2
|
|
748
|
|
|
749
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
750
|
c1c2cc(oc2ncc1F)CO
|
|
751
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
752
|
c1ccc2c(c1)NCCC(=O)N2
|
|
753
|
Cc1nnc(o1)Nc2ccccc2
|
|
754
|
c1ccn(c1)c2ccsc2CO
|
|
755
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
756
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
757
|
C1C(=O)N[C@@H]2C=CC=CN2C1=O
|
|
758
|
CCCCc1c2c(n[nH]1)CC(CC2=O)(C)C
|
|
759
|
Cn1cccc1[C@@]2(C(=O)NCCN2)C(F)(F)F
|
|
760
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
761
|
CCOC(=O)c1c(ocn1)[C@@H]2COC(O2)(C)C
|
|
762
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
763
|
Cn1c(c(cn1)c2nc(no2)C3CC3)N
|
|
764
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
765
|
CCc1cnnn1c2c(non2)N
|
|
766
|
Cc1ccc(o1)[C@@H]2C[C@@H](n3c(ccn3)N2)C(F)(F)F
|
|
767
|
Cc1[nH]c2c(n1)C(=O)CCC2
|
|
768
|
CCOC(=O)c1c(n2cnnc2s1)C
|
|
769
|
CCOC(=O)C1=C(Nn2cnnc2S1)C
|
|
770
|
CC(=O)Nc1c(cn[nH]1)C#N
|
|
771
|
c1ccc(cc1)Nc2nnns2
|
|
772
|
c1ccc(cc1)CNc2cnoc2
|
|
773
|
c1ccc2c(c1)CNC(=O)CS2
|
|
774
|
c1ccc2c(c1)[C@@H]3C4=C(CCCC4)C(=C3NC2=O)C(=O)N
|
|
775
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
776
|
COC1=C(C(C1(F)F)(F)F)OC
|
|
777
|
C1C[C@H]2C=C[C@@H]1[C@@H]([C@H]2C#N)C#N
|
|
778
|
c1ccc-2c(c1)CCNc3c2cccc3
|
|
779
|
Cc1ccc(n1c2ccc3c(c2)nns3)C
|
|
780
|
c1nc(c(n1Cc2n[n-]nn2)Cl)Cl
|
|
781
|
C1C[C@@H]2C(=O)NCCS(=O)(=O)N2C1
|
|
782
|
CC(C)(C)c1cnnc(n1)N
|
|
783
|
COC(=O)c1ccc(o1)C#N
|
|
784
|
c1ccc2c(c1)C[C@@]3(c4ccccc4C=C3NC2=O)O
|
|
785
|
c1c(cc(c2c1[nH]nc2)O)O
|
|
786
|
c1ccc(cc1)Sc2cnns2
|
|
787
|
c1cc(sc1)c2c(non2)N
|
|
788
|
CCOC(=O)C1=C(N[C@@]2(C[C@H]1[C@H]3CO[C@@H]2O3)O)C
|
|
789
|
Cc1cc(no1)n2c(c[nH]c2=O)C
|
|
790
|
C1CCC2C(C1)[C@@H]3C[C@]2(C=C3)CO
|
|
791
|
c1cc(nc2c1NC(=O)C2)F
|
|
792
|
Cc1csc2c1n3c(c(nn3)C#N)[nH]c2=O
|
|
793
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
794
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
795
|
CN1CC2CCCCC2C1C3NC(NC(N3)F)N
|
|
796
|
C[C@@H]1Cc2c3c(cccc3N1)ncn2
|
|
797
|
Cc1nc-2c(n1O)CCc3c2non3
|
|
798
|
CSC1C2C3C(C(NNN3)CL)SC2NS1
|
|
799
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
800
|
c1ccc(cc1)C2=CCC(=O)O2
|
|
801
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
802
|
C1CC([NH]C1)C(=O)OCC#N
|
|
803
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
804
|
c1c(cncn1)n2cc(nc2)N
|
|
805
|
c1ccc(cc1)C2=NC(=O)CCC2
|
|
806
|
C1COCCC1(CC#N)C#N
|
|
807
|
C/C(=N/Cc1ccc(cc1)F)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
808
|
CCc1nnc(s1)[N-]S(=O)(=O)N2CCCCC2
|
|
809
|
CC1=CC(=O)N=C2C1=C([C@H](S2)C(=O)OC)N
|
|
810
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
811
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
812
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
813
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
814
|
c1ccc2c(c1)c3c([nH]2)SCCS3
|
|
815
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
816
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
817
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
818
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
819
|
CC#CCC/C=C(/C)CCO
|
|
820
|
c1ccc2c(c1)[C@@H]3CCC(=O)N3CN2
|
|
821
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
822
|
C[C@H]([C@@H]1[C@@H](NC1=O)CC(=O)OC)O
|
|
823
|
c1cc(c2nncn2c1)Cl
|
|
824
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
825
|
C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O)NC(=O)C)O
|
|
826
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
827
|
Cc1c(nc(c(n1)C(=O)NC)NC)CCC(=O)[O-]
|
|
828
|
c1cc(c(cc1c2ccc(c(c2)O)N)O)N
|
|
829
|
c1ccc2c(c1)c(=O)n3c(n2)ccc(=O)[nH]3
|
|
830
|
C1C2C(NCN1)SC=C(N2)O
|
|
831
|
c1csc2c1c(n[nH]c2=O)N
|
|
832
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
833
|
Cc1c(cco1)c2nnc(n2C)SC
|
|
834
|
Cc1c2c(on1)C=C(CC2)c3ccccc3
|
|
835
|
CS(=O)(=O)NC[C@@H]1C[C@H]2C[C@@H]1C=C2
|
|
836
|
COC(=O)c1cccc2c1c([nH]n2)Br
|
|
837
|
CCn1c(=O)n-2c(n1)COc3c2cc(cc3)Cl
|
|
838
|
Cn1cccc1c2ccsc2N(C)C
|
|
839
|
CSc1nnc2n1[nH]cn2
|
|
840
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
841
|
CSc1c(c(sn1)SC)NC(=O)N2CCCC2
|
|
842
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
843
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
844
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
845
|
c1ccc(cc1)/C=C/2NC(=O)C(=O)O2
|
|
846
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
847
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
848
|
c1ccc2c(c1)nnn2c3ccc4nnnn4n3
|
|
849
|
Cc1coc(=O)n1c2ccc(c(c2)Cl)Cl
|
|
850
|
C1=CC2=CC(=O)O[C@@H]2[C@@H]([C@@H]1O)O
|
|
851
|
C1CCC2C(C1)C3C(O2)C(=O)C(CS3)C(=O)[O-]
|
|
852
|
c1cc2c([nH]nc2Cl)nc1
|
|
853
|
CNC(=O)Oc1ccccc1
|
|
854
|
CC(=O)NCCn1cccn1
|
|
855
|
C=Cn1cccc1c2ccco2
|
|
856
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
857
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
858
|
Cc1c2cnnc(n2cn1)Nc3cccnc3
|
|
859
|
c1nncn1N2C3=CCCCC3=C(C2=O)O
|
|
860
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
861
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
862
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
863
|
C1CCC(CC1)/C=C/2CCCCC(=O)N2
|
|
864
|
CC1NC(ON1)C2CCCO2
|
|
865
|
C1CCC2C(C1)C3=NC4CCNCC4CN3C2=O
|
|
866
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
867
|
C[C@@]1(C(OC(=O)N1CCc2c[nH+]c[nH]2)(C)C)O
|
|
868
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
869
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
870
|
c1c[nH]c2c1c(ncc2)Cl
|
|
871
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
872
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
873
|
c1csc2c1CN(CC2)C(=O)N
|
|
874
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
875
|
CCOC(=O)/C=C/1CC(=O)Nc2c(non2)N1
|
|
876
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
877
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
878
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
879
|
c1ccc2c(c1)CN3CCCC3=[NH+]2
|
|
880
|
c1c(c(on1)C2CC2)C(=O)[O-]
|
|
881
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
882
|
Cc1cc(cc2n1nnn2)O
|
|
883
|
C=Cn1cccc1c2cccs2
|
|
884
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
885
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
886
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
887
|
C1=C[C@@]2([C@@H]3[C@@H]([C@H]1O2)C(=NC3=O)[O-])CO
|
|
888
|
CN1CNC(=O)c2c1n[nH]n2
|
|
889
|
C1NC2C(C(N1)N)NCNC2N
|
|
890
|
c1cnc(=O)n2c1SCC2=O
|
|
891
|
c1nc([nH]n1)c2c(non2)N
|
|
892
|
c1cc2cccc3c2c(c1)N=C4N3C(=O)OC4
|
|
893
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
894
|
c1ccc2c(c1)c3c([nH]2)cccc3O
|
|
895
|
c1csc(n1)n2cnnn2
|
|
896
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
897
|
c1cc(nnc1n2cncn2)[O-]
|
|
898
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
899
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
900
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
901
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
902
|
C[C@@]1(C(=O)N=C2N1C=CC=C2)CC(=O)[O-]
|
|
903
|
C1CC2C(C(N[NH]C2=O)[O-])C1
|
|
904
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
905
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
906
|
CCc1cc2cnsc2s1
|
|
907
|
c1c2c(nc(n1)N)CCCC2=O
|
|
908
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
909
|
CNC2CCC(CC2[NH]/C1=NC(=O)C3NC([NH]N3)[O-])CL
|
|
910
|
CCC(=O)Oc1csnn1
|
|
911
|
c1ccc(cc1)c2c3c(non3)on2
|
|
912
|
c1ccc(cc1)[C@H]2C[C@](N=C(N2)N)(C(F)(F)F)O
|
|
913
|
Cc1c(c(on1)N)C2=CCN(CC2)C(=O)C
|
|
914
|
Cn1c(ccn1)c2nnc(o2)N
|
|
915
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
916
|
c1ccc2c(c1)CCC(=C2)c3cccnc3
|
|
917
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
918
|
c1ccc(cc1)C2=CC[C@@](C=C2)(C#N)F
|
|
919
|
Cc1c2cc(ccc2[nH]n1)F
|
|
920
|
Cc1c(c(n[nH]1)O)[C@@H]2c3ccccc3C(=O)O2
|
|
921
|
c1ccc(cc1)c2ncc(s2)c3ccno3
|
|
922
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
923
|
c1ccc2c(c1)N[C@@H]3CC(=N2)[C@@H]4OC[C@H]3O4
|
|
924
|
c1ccc2c(c1)nc3n2C4(CCCC4)NC(=[NH+]3)N
|
|
925
|
CCSc1[nH]c(c(n1)C)CC(C)C
|
|
926
|
C[C@@]1(C(OC(=O)N1n2cnnc2)(C)C)O
|
|
927
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
928
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
929
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
930
|
C1CC(OC1)(C2CC2)C3CC3
|
|
931
|
CC[C@@H]1C2=C(CN(C2=O)CC(=O)[O-])NC(=O)N1
|
|
932
|
c1ccc(cc1)CCOn2ccnc2
|
|
933
|
CC1(C[C@@H]2[C@@H](C1)[C@](Cc3cocc3[C@@H]2O)(C)O)C
|
|
934
|
c1ccc2c(c1)NC(=O)CCO2
|
|
935
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
936
|
c1cn(cn1)[C@@H]2CC([C@@H]3OC[C@H]2O3)(O)O
|
|
937
|
c1cc(oc1)c2cc(on2)N
|
|
938
|
c1cocc1c2nc([nH]n2)N
|
|
939
|
c1ccc(cc1)C2OCc3c(non3)CO2
|
|
940
|
CC(C)([C@@H](Cc1ccc2c(c1O)COC2)O)O
|
|
941
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
942
|
C1Cc2c(nnc(c2C(F)(F)F)[O-])C1
|
|
943
|
CC(C)c1nc(=O)cc(o1)C(F)(F)F
|
|
944
|
Cn1cc2c(c1c3ccc(cc3)N)c(=O)[nH]nc2[O-]
|
|
945
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
946
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
947
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
948
|
CC(=O)Nc1ccc2c(c1)ccs2
|
|
949
|
CC(=O)c1csc(n1)c2ccno2
|
|
950
|
c1c2c(=O)[nH]c(nc2n[nH]1)[O-]
|
|
951
|
C=CCNc1nc(ns1)N
|
|
952
|
Cc1cc([nH]n1)OCCC#N
|
|
953
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
954
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
955
|
c1ccc2c(c1)-c3ccccc3S(=O)(=O)N2
|
|
956
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
957
|
C1[C@@H]2C=C[C@H]1[C@@]3([C@@]2(C(=NC3=O)N)C#N)C#N
|
|
958
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
959
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
960
|
CCN1CC(=C(C=C1O)C)C(=O)N
|
|
961
|
c1nc(no1)c2c(non2)N
|
|
962
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
963
|
CCCNC(=O)Nc1c(c(c(o1)C)C)C#N
|
|
964
|
c1csc(c1C#N)n2cc(c(=O)[nH]c2=O)C#N
|
|
965
|
c1ccc2c(c1)CCC3=C2CCC(=O)N3
|
|
966
|
Cc1c(n2c(n1)CCCCC2)O
|
|
967
|
|
|
968
|
Cc1nnc(o1)CSc2ccccn2
|
|
969
|
c1ccc2c(c1)-c3c(nc4nnnn4n3)C2=O
|
|
970
|
CCCNC(=O)Cc1nc[nH]n1
|
|
971
|
CS(=O)(=O)NC[C@@H]1CCCO1
|
|
972
|
CC1(C[C@@H](C(=O)C1)[C@@]23COC(=O)C(=C2C=C3)CO)C
|
|
973
|
c1ccc(cc1)n2c(nnn2)Sc3nc4ccccc4o3
|
|
974
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
975
|
Cc1c(non1)c2ccnc3n2c(nn3)N
|
|
976
|
Cc1c(c(on1)C)S(=O)(=O)n2ccnc2
|
|
977
|
CCOC(=O)Cn1nnnn1
|
|
978
|
Cc1[nH]c(c(n1)Cl)Cl
|
|
979
|
C1CCC2C(C1)-N3CCCC3[C@@H](S2)C#N
|
|
980
|
c1cc(cnc1)c2cccs2
|
|
981
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
982
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
983
|
C1C[C@@H]2C(=O)NCC(=O)N2C1
|
|
984
|
CC(=O)c1cc2cnccc2[nH]c1=O
|
|
985
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
986
|
CC1=CC(=C(O[C@@H]1c2cccnc2)C)C(=O)OC
|
|
987
|
Cc1c2c(on1)COc3ccccc3C(=O)C2
|
|
988
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
989
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
990
|
CCCC[C@@]1(CN(C(=O)OC1)C)CC
|
|
991
|
CCCc1nc([nH]n1)c2ccccc2O
|
|
992
|
C1C=C[C@@H]([C@]2([C@@H]1C([C@@]2(F)CL)(F)F)CL)O
|
|
993
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
994
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
995
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
996
|
COC(=O)N1CCc2c(c(ns2)[O-])C1
|
|
997
|
|
|
998
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
999
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
1000
|
CC1=C[C@@](NC(=O)N1)(C)[C@@]2(C=C(NC(=O)N2)C)C
|
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