(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
2
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2ccno2
|
|
3
|
CC(C)c1nc([nH]n1)CC#N
|
|
4
|
CC1=C([C@@H](C(=C(O1)N)C(=O)OC)c2ccc[nH]2)C(=O)N
|
|
5
|
c1ccc2c(c1)-c3c4c(cc5c3OCO5)CCN[C@@H]4[C@H]2O
|
|
6
|
Cc1[nH]cc(n1)c2ccccc2
|
|
7
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
8
|
c1ccc(c(c1)C(=O)[O-])[n+]2cc(on2)[O-]
|
|
9
|
c1cc(sc1)CCn2cnc(n2)C#N
|
|
10
|
CC(C)(C#CC(=O)[O-])C#CC(=O)[O-]
|
|
11
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
12
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
13
|
c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
|
|
14
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
15
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
16
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
17
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
18
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
19
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
20
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
21
|
Cc1c2c(n(n1)c3ccccc3)N[S@@](=O)N2
|
|
22
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
23
|
c1nc(nn1CC(=O)N)C#N
|
|
24
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
25
|
CC1=NS(=O)(=O)NC2=C1CCCC2
|
|
26
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
27
|
CC(=O)NCCc1coc2c1ccnc2
|
|
28
|
c1ccc(cc1)Oc2ccc(o2)CO
|
|
29
|
CCCCc1[nH]cc([nH+]1)CO
|
|
30
|
CC1NC(NO1)C2(CCCC2)NC(=O)C
|
|
31
|
CNC(=O)N=c1c(=O)c2ccccc2c1=O
|
|
32
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
33
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
34
|
|
|
35
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
36
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
37
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
38
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
39
|
COC(=O)C1=C(CC1)C(=O)OC
|
|
40
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
41
|
c1ccc(cc1)n2c(nc(n2)[O-])c3cccs3
|
|
42
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
43
|
c1ccc2c(c1)-c3c(cc(c(=O)o3)C(=O)N)CO2
|
|
44
|
CC(=O)N[C@@H]1CCC=C1C2=CCC[C@H]2NC(=O)C
|
|
45
|
C1CC2N(C1)CC3CC4C(CC3N=C2)OCO4
|
|
46
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
47
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
48
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
49
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
50
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
51
|
CNC(=O)N(c1ccccc1)C2=NCCCCC2
|
|
52
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
53
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
54
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
55
|
C1CCC2C(C1)-N3CCCC3[C@@H](S2)C#N
|
|
56
|
c1ccc2c(c1)c(ccn2)c3cocn3
|
|
57
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
58
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
59
|
C1CCC(CC1)CC2CCC[NH]2
|
|
60
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
61
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
62
|
C[C@@]1(C[C@@H](NN2C3CCCCC3C4C2C1CCC4)CO)CO
|
|
63
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
64
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
65
|
c1cc(oc1)C(=O)c2[nH]cc[nH+]2
|
|
66
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
67
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
68
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
69
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
70
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
71
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
72
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
73
|
c1ccc2c(c1)OCc3cc(ccc3O2)N
|
|
74
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
75
|
CC1=C(CCO1)C(=O)NCCO
|
|
76
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
77
|
c1ccc2c(c1)Cc3ccccc3N=C2C#N
|
|
78
|
c1cc2cccc3c2c(c1)C4=NCCN=C34
|
|
79
|
Cc1c(c2cc(ccc2[nH]1)F)CCn3cnnn3
|
|
80
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
81
|
c1ccc(cc1)Sc2c[nH]cn2
|
|
82
|
c1ccc(cc1)c2cc(=O)on2c3ccccc3
|
|
83
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
84
|
|
|
85
|
CCOC=C(c1nnco1)c2nnco2
|
|
86
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
87
|
c1ccc(cc1)C2=C(NNC(=[NH2+])N2)c3ccccc3
|
|
88
|
c1ccc2c(c1)-c3nncn3-c4ccccc4S2
|
|
89
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
90
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
91
|
Cn1c(cc(n1)c2ccccc(=O)c2[O-])C(=O)[O-]
|
|
92
|
C1CCC(CC1)OCC2CN[NH]N2
|
|
93
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
94
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
95
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
96
|
C1CCC2C(C1)C3C(C(=O)S2)C=CCO3
|
|
97
|
CCCNC(=O)Cc1nc[nH]n1
|
|
98
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
99
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
100
|
Cc1cc(n(n1)CCc2nnco2)C
|
|
101
|
|
|
102
|
c1cc2c(nc1C#N)CCCN2
|
|
103
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
104
|
c1ccc2c(c1)nnn2c3ccc4nnnn4n3
|
|
105
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
106
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
107
|
COC(=O)c1c(ccs1)n2cc(c(=O)[nH]c2=O)C#N
|
|
108
|
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
|
|
109
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
110
|
c1ccc2c(c1)c(c3ccccc3n2)Nn4cnnc4
|
|
111
|
COC(=O)c1c(=O)n([nH]n1)Cc2cccs2
|
|
112
|
Cc1c-2c(n(n1)C)CCc3c2sc(c3)C(=O)[O-]
|
|
113
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
114
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
115
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
116
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
117
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
118
|
c1cscc1OC(=O)C2=NC(=O)CC=C2
|
|
119
|
CC(C)Oc1c(c(=O)c1=O)c2ccco2
|
|
120
|
CCOC(=O)/C=C/CCCc2c1cco2
|
|
121
|
C1=C/C(=C/C(=NNN2)C(=O)[O-])/C(=O)C=C1
|
|
122
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
123
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
124
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
125
|
C[C@@H](C(=O)C1=N[C@@H]2C(=[NH+]C1)NC(=NC2=O)[NH-])[O-]
|
|
126
|
CNC(=O)NCNC(=O)NC
|
|
127
|
c1ccc(cc1)S(=O)(=O)[N-]c2cccnc2
|
|
128
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
129
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
130
|
CC1(NC(=O)[C@@]2(O1)C[C@@H](C=C2CO)O)C
|
|
131
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
132
|
CNC(=O)N[C@@H]1CCCC=C1
|
|
133
|
C[C@@H](c1cccc(c1)n2cccc2)NS(=O)(=O)C
|
|
134
|
c1ccc(cc1)NCn2cncn2
|
|
135
|
c1ccc(cc1)S(=O)(=O)Nc2ccon2
|
|
136
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
137
|
c1ccc-2c(c1)CC(=O)Cc3c2cccc3
|
|
138
|
c1c([nH]nn1)SCC(=O)N
|
|
139
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
140
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
141
|
c1cc2cccc3c2c(c1)OS3(=O)=O
|
|
142
|
CC1(C[C@@H]2[C@@H](C1)[C@](Cc3cocc3[C@@H]2O)(C)O)C
|
|
143
|
C1=CC=CC(C=C1)NC(=O)N
|
|
144
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
145
|
Cc1cc(n(n1)c2nc(nc(n2)OC)n3c(cc(n3)C)C)C
|
|
146
|
c1cc(=O)oc2c1cc3c(c2O)OC=CC3
|
|
147
|
c1ccc2c(c1)[nH]c(n2)NC3=NC(=O)C(=N3)[O-]
|
|
148
|
CCOC1C-2C(NC(N1)N)CCC3C2CCCC3
|
|
149
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
150
|
Cc1csc(n1)NC(=O)c2c(nns2)C
|
|
151
|
[H]/N=C/1NC(C2C(O1)C3CCCCC3N(C2=O)C)C
|
|
152
|
c1csc2c1CCO[C@@H]2CC(=O)[O-]
|
|
153
|
COC1=CC(=O)O[C@@H](C1)C2CCCO2
|
|
154
|
CN1CC[C@@H]2C1=NC3CCCCC3[C@@]2(C(=O)OC)O
|
|
155
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
156
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
157
|
c1cc(sc1)Sc2nc(ns2)Cl
|
|
158
|
CS(=O)(=O)N[C@@H]1CCc2c1cccc2
|
|
159
|
c1cc2c(cc1C#N)CCCC=C2
|
|
160
|
C=CCOC1CCNC(N1)N
|
|
161
|
c1ccc2c(c1)c3c(cc(s3)C(=O)[O-])c(=O)o2
|
|
162
|
Cn1c2c([nH]c1=O)nncn2
|
|
163
|
c1ccc(cc1)NC(=O)c2[n-]ncn2
|
|
164
|
Cc1ccc(o1)/C=C(C)/CO
|
|
165
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
166
|
CC(=O)Oc1c(c(c([nH]1)C(=O)OC)O)O
|
|
167
|
c1cc(sc1)C2=C(C(=O)OC2)c3cccs3
|
|
168
|
c1nc-2c3nc(on3cnc2n1)[O-]
|
|
169
|
C[C@@]1(c2cccn2-c3ccccc3CO1)C(=O)[O-]
|
|
170
|
C1COCCN1C2C(=O)NC(SN2)N
|
|
171
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
172
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
173
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
174
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
175
|
CCCCCCC1CN[NH]N1
|
|
176
|
Cn1c(cc(c1SC)c2ccco2)OC
|
|
177
|
c1ccc2c(c1)c(=O)oc(=O)c3n2ccc3
|
|
178
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
179
|
c1ccc2c(c1)cccc2C[C@@H]3NCC=N3
|
|
180
|
CC1(CC2=NC(=CC(=O)[C@@H]2C(=O)C1)[O-])C
|
|
181
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
182
|
CN1C(=O)C2CC(C(=O)OC2N(C1=O)C)C(=O)N
|
|
183
|
c1cc(oc1)c2nc([nH]n2)N
|
|
184
|
c1ccc2c(c1)CCC3=C(CC2=O)C(=O)OC3
|
|
185
|
CC(C)Oc1c(c(=O)c1=O)c2cccs2
|
|
186
|
c1ccc2c(c1)CC[NH+]=C2c3ccco3
|
|
187
|
C(CS(=O)(=O)N)NC(=O)N
|
|
188
|
CC1(OC[C@@H](O1)CC(=O)N)C
|
|
189
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
190
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
191
|
CNc1ccc(cc1F)C#N
|
|
192
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
193
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
194
|
c1ccc(c(c1)C(F)(F)F)/N=c/2[nH]cnc(n2)N
|
|
195
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
196
|
c1ccc(cc1)c2c(oc(=O)o2)c3ccccc3
|
|
197
|
c1ccc(cc1)[C@H](C(=O)[C@H]2C=CC=N2)O
|
|
198
|
CCOC(=O)C1=C(NC(=O)N[C@@H]1C)c2cccs2
|
|
199
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
200
|
c1cc(ccc1N)Oc2nccs2
|
|
201
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2C=CC=C3)C#N
|
|
202
|
c1ccc2c(c1)-c3c(cc(s3)C(=O)[O-])CS2
|
|
203
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
204
|
CCNC(=O)[C@@H](C)n1cnnc1C#N
|
|
205
|
CCSc1nnc(o1)c2ccc[nH]2
|
|
206
|
CC(=O)NCc1ccccn1
|
|
207
|
C1=C([C@H]2C(=NC1=O)C(=C(S2)SCC#N)C#N)[O-]
|
|
208
|
c1cc(oc1)c2cc(=O)n3cnnc3s2
|
|
209
|
c1ccc2c(c1)C[NH2+]C2=C(C#N)C#N
|
|
210
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
211
|
CCOC(=O)N[C@@H]1c2ccccc2O[C@@H]3[C@@H]1C=CC=C3
|
|
212
|
c1ccc-2c(c1)CNC(=O)c3c2cccc3
|
|
213
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
214
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
215
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
216
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
217
|
COC(=O)Cc1cccnn1
|
|
218
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
219
|
c1ccc(cc1)C2=NCC(=O)O2
|
|
220
|
c1ccc2c(c1)-c3ccccc3S2(=O)=O
|
|
221
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
222
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
223
|
Cccccn(/c1=[NH+]C(=O)C2CC2)C(=O)C3CC3
|
|
224
|
c1ccc2c(c1)N=C(CN2C(=O)NCC(=O)[O-])O
|
|
225
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
226
|
c1ccc(cc1)C2=NC23c4ccccc4-c5c3cccc5
|
|
227
|
C1CCC2C(C1)-C3C(CCCN3)S2(=O)=O
|
|
228
|
C/C=C/[C@@H]1CC(=CC(=O)O1)OC
|
|
229
|
c1ccc2c(c1)CCc3ccccc3C2
|
|
230
|
Cc1cc([nH]n1)OCCC#N
|
|
231
|
Cc1cc-2n(n1)[C@@H](Nc3c2cccc3)c4cccnc4
|
|
232
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
233
|
CO[C@@H]1c2cccc3c2c(ccc3)[C@@H]1NS(=O)(=O)C
|
|
234
|
Cc1ccc(cc1)Nc2nc(=[NH2+])ss2
|
|
235
|
COC(=O)[C@@H]1CCC(=O)c2n1ccc2
|
|
236
|
c1cc(oc1)c2nc(on2)CO
|
|
237
|
c1ccn(c1)c2ccc(cc2)SCC(=O)[O-]
|
|
238
|
c1ccc2c(c1)c(c[nH]2)Cn3cnnc3
|
|
239
|
COC1CCC2C(C1)CC[C@@H]3C2=C(CC3=O)C(=O)OC
|
|
240
|
c1cnn2c1N[C@H](CC2=O)CO
|
|
241
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
242
|
c1ccc(cc1)c2nc(=[NH2+])sn2c3ccccc3
|
|
243
|
CCCC1=C([C@@H](n2c(ncn2)N1)C)C(=O)OCC
|
|
244
|
c1ccc-2c(c1)CCc3c2cccc3
|
|
245
|
COC1=NCc2ccccc2-c3c1cccc3
|
|
246
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
247
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
248
|
Cc1c(nc(nc1c2c[nH]nc2)C(F)(F)F)C
|
|
249
|
CCc1c(ccn1C=C)c2ccccc2
|
|
250
|
c1csc2c1S(=O)(=O)NCC2=O
|
|
251
|
CCOC(=O)C1=C(NC(=N[C@@H]1c2ccccc2)O)C
|
|
252
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
253
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
254
|
|
|
255
|
CNC1C(NC2C(N1)N(C(=O)N2C)C)C(=O)NC
|
|
256
|
COc1cc2c(cc1OC)-c3cccn3CC2
|
|
257
|
c1ccc2c(c1)-c3nc4ccccc4n3CC(=O)N2
|
|
258
|
C1C#C/C=CC#CC[C@@H]([C@@H]1CO)CO
|
|
259
|
Cc1cnc(o1)CSc2ccccc2
|
|
260
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
261
|
CCOC(=O)[C@@H](C#N)C1=NCCC1
|
|
262
|
Cn1c2c(cn1)NC(=O)NS2(=O)=O
|
|
263
|
c1ccc(cc1)[C@@H]2OCc3c(ccc(n3)CO)O2
|
|
264
|
c1c2c(c3c(c1Br)non3)nno2
|
|
265
|
c1cc2cccc3c2c(c1)N=C4N3C(=O)OC4
|
|
266
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
267
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
268
|
c1c(cc2c3c1occ3CC(=O)O2)O
|
|
269
|
Cc1csc(n1)c2nnc(o2)N
|
|
270
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
271
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
272
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
273
|
c1ccc(cc1)Sc2[nH]ncn2
|
|
274
|
CC(=O)NCCn1cccn1
|
|
275
|
CNC(=O)c1c2c(c(=O)oc1N)nns2
|
|
276
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
277
|
c1ccc2c(c1)C(=O)[C@@]3([C@@]2(Nc4c(non4)N3)O)O
|
|
278
|
c1(c(non1)N)c2nnc(o2)N
|
|
279
|
COC(=O)c1c(cc(=O)n2c1CCCCC2)[O-]
|
|
280
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
281
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
282
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
283
|
CN1c2cnc(nc2-c3c(ccs3)S1(=O)=O)N
|
|
284
|
COc1ccc2c(c1)C(=O)OCCC2
|
|
285
|
c1ccc(cc1)S(=O)(=O)Nn2cnnc2
|
|
286
|
Cc1nc(on1)NC(=O)c2ccccc2
|
|
287
|
c1cc(nnc1n2cncn2)[O-]
|
|
288
|
c1cncc(c1Sc2nnns2)S(=O)(=O)N
|
|
289
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
290
|
c1cc(sc1)C(=O)[C@@H]2CCC(=O)O2
|
|
291
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
292
|
c1ccc-2c(c1)CCNc3c2cccc3
|
|
293
|
COC1=CCCc2c1cccc2
|
|
294
|
CC1CCC(O1)C2CCCC(=O)O2
|
|
295
|
Cc1ccc(n1c2ccc3c(c2)nns3)C
|
|
296
|
c1ccc(c(c1)C(=O)c2cnoc2)O
|
|
297
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
298
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
299
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
300
|
c1cocc1c2nc([nH]n2)N
|
|
301
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
302
|
Cc1cc(no1)CS(=O)(=O)NC
|
|
303
|
Cn1c(ccn1)C(=O)Nn2cnnc2
|
|
304
|
C[C@@H]1[C@H]([C@@H](C[C@@H](O1)O)NC(=O)C)O
|
|
305
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
306
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
307
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
308
|
Cc1nc(on1)/C=C/c2ccccc2O
|
|
309
|
Cn1c(c(nnc1=O)c2ccsc2)c3ccsc3
|
|
310
|
c1cc(cc(c1)n2c(c(n(c2=O)C3CC3)[O-])[O-])N
|
|
311
|
c1ccc-2c(c1)CSc3c2cccc3
|
|
312
|
COc1cccc(c1)S(=O)(=O)[C@@H]2CC=NC2
|
|
313
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
314
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
315
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
316
|
CC(=O)c1ccc2nnnn2c1
|
|
317
|
COC1CC2C(CC1O)-C3C(CNO3)CCC2
|
|
318
|
Cc1cc(=O)n2c3c1ccc(c3OC2)N
|
|
319
|
c1ccc2c(c1)NCCC(=N2)c3ccco3
|
|
320
|
c1ccc(cc1)C2=CC(=O)O[C@@]23CCCC=C3
|
|
321
|
CCOC(=O)N1CCNC(=O)C1
|
|
322
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
323
|
C1CC2N(C1)-C3C(CCS3)CN=C2
|
|
324
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
325
|
CC(=O)NC[C@@H](c1ccco1)S(=O)(=O)c2ccccc2
|
|
326
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
327
|
c1ccc2c(c1)[C@@H]3c4c([nH]c(=O)s4)SC=C3CO2
|
|
328
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
329
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
330
|
Cc1c(non1)NS(=O)(=O)c2ccccc2
|
|
331
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
332
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
333
|
C1CCC2C(C1)C=NC3CCCCC3S2
|
|
334
|
Cc1cc(=O)oc-2c1C(=O)c3c2cccc3
|
|
335
|
c1csc(n1)C(=O)CC#N
|
|
336
|
c1ccc2c(c1)nnn2c3cnns3
|
|
337
|
C1CCC2C(C1)-C3CCCC4C3[C@@H]2OC4=O
|
|
338
|
CN1C2CCCCC2S(=O)(=O)N3C1NNN3
|
|
339
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
340
|
COC(=O)/C/1=C(/C(=C(CCCC1)[O-])C(=O)OC)C(=O)OC
|
|
341
|
Cc1cc(n(n1)C(=O)c2cc(on2)C)C
|
|
342
|
COC(=O)N1C[C@@H]2CC=C[C@@H](C2)C3C1CCCC3
|
|
343
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
344
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
345
|
COC(=O)C[C@@]1(C(=C(C(=N1)[O-])N)C(=O)OC)C(=O)OC
|
|
346
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
347
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
348
|
COc1cc(=O)nc(o1)c2ccco2
|
|
349
|
CC1(Cc2c(cc3c(n2)[nH]c(=O)[nH]3)CO1)C
|
|
350
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
351
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
352
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
353
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
354
|
Cc1ccc(c(c1)n2cccn2)c3c4c(nc[nH]4)ncn3
|
|
355
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
356
|
C1CCC2C(C1)[C@@H]3C4CCNCC4[C@H]2O3
|
|
357
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
358
|
c1cc(nc2c1NC(=O)C2)F
|
|
359
|
c1cc(c(nc1)Sc2cn[nH]n2)C(F)(F)F
|
|
360
|
C1CC(C(CC1O)C2=NCCC2)O
|
|
361
|
c1cnc(cn1)c2nnc(o2)N
|
|
362
|
c1cc(ccc1C2=C(CCC2)c3ccncc3)F
|
|
363
|
CC1=Cc2c(ccc3c2non3)N(C1)C
|
|
364
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
365
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
366
|
COC(=O)C1=NC(=CC(=O)C1)C(=O)OC
|
|
367
|
Cc1c(c-2c(cn1)CCc3c2cccc3)C#N
|
|
368
|
c1ccc(cc1)C2=C(NC(=O)CC2)c3ccccc3
|
|
369
|
c1ccc(cc1)/C=C/c2[nH]ccn2
|
|
370
|
C1[C@@H]([C@H](O[C@H]1[C@@H]2C=CC=NC2=O)CO)O
|
|
371
|
Cc1c(cn(n1)C)n2cnnn2
|
|
372
|
Cc1ncc2c(n1)-c3cc(ccc3SC2)F
|
|
373
|
C1CCC2C(C1)-C3CCCNC3S2(=O)=O
|
|
374
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
375
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
376
|
COC(=O)c1cc2c(cc[nH]2)c(c1)O
|
|
377
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
378
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
379
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
380
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
381
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
382
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
383
|
c1ccc(cc1)C2=C(C(=O)N3[C@@H]2CCC3)O
|
|
384
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
385
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
386
|
c1ccc(cc1)C2=NC(=O)CC(=O)N2
|
|
387
|
c1cc2ccc3cccc4c3c2c(c1)C4
|
|
388
|
c1ccc2c(c1)nnn2c3nnns3
|
|
389
|
c1ccc(cc1)c2c3c(non3)on2
|
|
390
|
COC(=O)N1CCc2c(onc2[O-])C1
|
|
391
|
c1ccc(cc1)c2c(c(sc2SCC#N)C#N)N
|
|
392
|
c1cnc(c2c1scc2)C#CCO
|
|
393
|
COC(=O)c1c2c(n3cnnc3n1)OCC2
|
|
394
|
Cc1c2c(nc(s2)C#N)n(n1)C
|
|
395
|
Cn1cc(cn1)c2c(c(=O)c3ccccc3o2)[O-]
|
|
396
|
C[C@H]1CO[C@]2(C(=C(C=C(O2)O)OC)C1=O)C
|
|
397
|
COC(=O)C1=NCC(=O)Nc2c1cccc2
|
|
398
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
399
|
Cc1cc(n(n1)C(=O)NC)C
|
|
400
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
401
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
402
|
COC(=O)CC1=Nc2nncn2C1=O
|
|
403
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
404
|
CC1=NS(=O)(=O)N=C(O1)OC
|
|
405
|
CC1(Cc2ccccc2/C(=C/C(=O)N)/C1)C
|
|
406
|
CCC/C=C/C2=C(C=CCC2)C(=O)O1
|
|
407
|
C=C1c2ccccc2C=Cc3c1cccc3
|
|
408
|
C1CCC2C(C1)CC3=NC(=O)N=C23
|
|
409
|
Cc1cc(n(n1)C(=O)c2c(n[n-]n2)Nc3ccccc3F)C
|
|
410
|
c1ccc2c(c1)C[C@@H]3CCNC=C3C2=O
|
|
411
|
Cc1csc(n1)c2cn[nH]c2N
|
|
412
|
CCc1nc(on1)c2cc(n[nH]2)C3CC3
|
|
413
|
c1(=O)c(nsnc1Cl)N
|
|
414
|
COC(=O)[C@@H]1CC2CNCN2C(=O)N1
|
|
415
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
416
|
c1cc2c(cc1O)occ(c2=O)c3cnc[nH]3
|
|
417
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
418
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
419
|
CC(=O)OC1=CC=CNC1=C(C#N)C#N
|
|
420
|
c1cc(c2c(c1)oc(=O)o2)C(F)(F)F
|
|
421
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
422
|
Cc1cc-2n(c1)CCn3c2ccc3
|
|
423
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
424
|
c1ccc2c(c1)-c3ccccc3NC(=O)N2
|
|
425
|
Cc1ccc2c(c1)-c3c(nn4c(n3)nnn4)C(O2)(C)C
|
|
426
|
COC(=O)[C@]12C(=NC=N1)C=NC=N2
|
|
427
|
C1[C@@H]2N(C1=O)[C@@H](/C(=C/CO)/O2)C(=O)[O-]
|
|
428
|
COc1c2ccccc2[nH+]c3c1cco3
|
|
429
|
COC(=O)c1c(snn1)[N-]S(=O)(=O)c2ccccc2
|
|
430
|
Cc1cnc(nc1c2ncnn2C)N
|
|
431
|
CS(=O)(=O)c1ccc2c(c1CCC(=O)[O-])O2
|
|
432
|
CC1=CC(=NS(=O)(=O)N1)C
|
|
433
|
c1cc(ccc1C2=C(N=CC2)c3ccncc3)F
|
|
434
|
c1cc2c(cc1S(=O)(=O)[O-])nc[nH]2
|
|
435
|
c1cc2c(cc1N)c3c(o2)CCC3
|
|
436
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
437
|
Cc1ccc(cc1)c2cnco2
|
|
438
|
Cc1ccc(n1c2c(c(c(o2)C)C)C#N)C
|
|
439
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
440
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
441
|
c1ccc2c(c1)CCN2c3ccc(s3)C(=O)[O-]
|
|
442
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
443
|
c1cnoc1c2nnc(o2)N
|
|
444
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
445
|
Cc1c(cnn1c2ccccc2)c3nnc(o3)[O-]
|
|
446
|
CC(=O)Nn1c2ccccc2nn1
|
|
447
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
448
|
CC(=O)n1c2ccccc2c3c1oc(c3C(=O)OC)C(=O)OC
|
|
449
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
450
|
c1ccc(cc1)Oc2ccccn2
|
|
451
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
452
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
453
|
c1ccn(c1)C(=O)[C@@H]2CC(=O)OC2
|
|
454
|
c1cc(oc1)[C@@H]2C[C@@H]2C(=O)[O-]
|
|
455
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
456
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
457
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
458
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
459
|
c1c(c(n[nH]1)n2cnnc2)C(=O)[O-]
|
|
460
|
c1nncn1N2C3=CCCCC3=C(C2=O)O
|
|
461
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
462
|
Cc1csc(n1)c2c(nc3n2ccs3)C
|
|
463
|
Cc1c2cc(sc2n(n1)C)CO
|
|
464
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
465
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
466
|
C1CC2C(CC1N)C=CCS2
|
|
467
|
c1ccc2c(c1)CCC3=C(C=C2)C(=O)OC3
|
|
468
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
469
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
470
|
c1ccc(cc1)CCc2csnn2
|
|
471
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
472
|
CCCCN/C(=CC1=NCCC1)/C
|
|
473
|
c1cnn(c1)c2ccc(cc2c3nnc4n3ccnc4)F
|
|
474
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
475
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
476
|
c1nc(nn1CC(F)(F)F)N
|
|
477
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
478
|
c1ccc-2c(c1)-c3cccc4c3c2ccc4
|
|
479
|
c1ccc2c(c1)CCN(C2)c3c(non3)[O-]
|
|
480
|
c1ccc2c(c1)c(c(s2)NC(=O)O)C#N
|
|
481
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
482
|
Cc1c(c(n(n1)C)Sc2ccccn2)N
|
|
483
|
c1ccc2c(c1)-c3c4c(cccc4[nH]n3)C2=O
|
|
484
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
485
|
c1ccc2c(c1)-n3cnnc3CCS2
|
|
486
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
487
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
488
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
489
|
CCCCC1CCC(CC1)c2nc(no2)N
|
|
490
|
C=CCOc1ccc(cc1)O
|
|
491
|
c1cc2c(cc1F)O[C@@H](S2)N
|
|
492
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
493
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
494
|
CCCCN1CCCc2ccccc2S1(=O)=O
|
|
495
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
496
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
497
|
COC1=C(C(=O)N[C@@H]1C(=O)c2ccccc2)C(=O)OC
|
|
498
|
c1ccc(cc1)CCn2cnnn2
|
|
499
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
500
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
501
|
Cc1c(nc(c(n1)C(=O)NC)NC)CCC(=O)[O-]
|
|
502
|
c1ccc(cc1)S(=O)(=O)Nc2nncs2
|
|
503
|
COC(=O)c1ccc(o1)[N-]S(=O)(=O)c2ccccc2
|
|
504
|
Cn1cnc2c1ncc(c2)C#N
|
|
505
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
506
|
Cc1nc-2c(n1O)CCc3c2non3
|
|
507
|
c1cc(oc1)c2ccnc3n2ncc3
|
|
508
|
CC(=O)Nn1cnc2c1cccc2
|
|
509
|
c1ccc2c(c1)N3C[C@H](CN=C3S2)O
|
|
510
|
CC1(OC(=CC(=O)O1)CC(=O)c2ccco2)C
|
|
511
|
c1ccc2c(c1)-c3ccccc3S(=O)(=O)N2
|
|
512
|
CCOC(=O)[C@@H]1C=C1C(C)(C)O
|
|
513
|
C=CCNC(=O)c1ccco1
|
|
514
|
CC1=Cc2c(c(c(c(c2C#N)N)C(=O)OC)C(=O)OC)C1
|
|
515
|
Cc1cc(=O)oc2c1sc3c2cccc3
|
|
516
|
Cc1c(c([nH]n1)n2cccc2)C(=O)[O-]
|
|
517
|
Cc1nc(c2n1ccnc2Cl)[C@@H]3CCOC3
|
|
518
|
Cc1c(cco1)c2nnc(o2)N
|
|
519
|
CSc1cc(c2c(c1C#N)CCCC2)C(F)(F)F
|
|
520
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
521
|
c1csc(c1n2cnnn2)C(=O)[O-]
|
|
522
|
CCCO[C@@H]1CCCN(C1)C(=O)c2ccnnc2
|
|
523
|
CC1=Nc2c(non2)N=C(C1)C
|
|
524
|
CC1(CC(=O)C2C3CCCCC3SC2O1)C
|
|
525
|
[H]/N=c/n2c(c(s1)c3ccccc3)NCC2
|
|
526
|
COC(=O)c1cc2c(n1C(=O)OC)snn2
|
|
527
|
c1ccc2c(c1)[C@@H](NCCO2)c3cccs3
|
|
528
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
529
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
530
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
531
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
532
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
533
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
534
|
c1ccc(cc1)C2=NC(=O)CCC2
|
|
535
|
C(COCCOCCO)O
|
|
536
|
C1CC([NH]C1)C(=O)OCC#N
|
|
537
|
CC1=Nc2ccccc2SC(C1)(C)C
|
|
538
|
Cn1cccc1CNc2[n-]nnn2
|
|
539
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
540
|
CCNC(=O)Cn1ccnc1
|
|
541
|
c1cn2c(c1CO)[C@@H](CC2)O
|
|
542
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
543
|
|
|
544
|
C1CCN(C(=O)C1)[C@@H]2C[C@@H]([C@@H](O2)CO)O
|
|
545
|
C/C=C/1Oc2ccc(cc2S1(=O)=O)OC
|
|
546
|
CCOC(=O)C1=C([C@@H]2C=C(C=C[C@@H]2N=C1)C)OCC#N
|
|
547
|
c1ncn(n1)NCNn2cncn2
|
|
548
|
CC1=C2CCOC2=Nc3ccccc3O1
|
|
549
|
c1ccc2c(c1)Cn3c(cnn3)C=N2
|
|
550
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
551
|
COc1c(cc2c-3c1COc4c3c(cc(c4)O)CC2)O
|
|
552
|
C#CCSc1nn2cnnc2o1
|
|
553
|
CCc1c(cccn1)C(=O)[O-]
|
|
554
|
c1ccc(cc1)C2=CCC(=O)O2
|
|
555
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
556
|
C=CCn1cc(ccc1=O)c2ccco2
|
|
557
|
COc1ccc(cc1)C2=NCCc3c2ccs3
|
|
558
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
559
|
CNC(=O)OCC#CCOC(=O)NC
|
|
560
|
c1cc(oc(=O)c1)c2cccnc2
|
|
561
|
Cc1c(sc(n1)C)c2nnc(o2)N
|
|
562
|
Cc1c(nccn1)c2ccn[nH]2
|
|
563
|
CC1=C([C@@H]2C[C@](N1)(Oc3c2cccc3)C)C(=O)OC
|
|
564
|
CCOC/C1=C/2CCOC2=O
|
|
565
|
|
|
566
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
567
|
CSc1/c(=CN)/n2cnnc2n1
|
|
568
|
Cn1c(nnn1)/N=C(/c2ccc(o2)Br)[O-]
|
|
569
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
570
|
c1ccc2c(c1)Cc3c(ccs3)C=C2
|
|
571
|
Cc1c(snn1)c2nnc(o2)C3CCCCC3
|
|
572
|
CC1=Nc2cccc3c2c1ccc3
|
|
573
|
CCCc1nncn1NC(=O)OCC
|
|
574
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
575
|
|
|
576
|
CC(=O)c1cc(cnc1)OC
|
|
577
|
C1CNC([NH]1)[C@@H]2CCCCN2C(=O)C3CC3
|
|
578
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
579
|
c1ccc(cc1)[C@@H]2C3=C(CCCC3)[NH+]=C4N2NN=N4
|
|
580
|
CNC(=O)Oc1ccccc1
|
|
581
|
Cc1nc(c(s1)c2nc[nH]n2)C(F)(F)F
|
|
582
|
c1ccc2c(c1)nnn2C3=[NH+]CCN3
|
|
583
|
CN(C)C(=O)N[C@@H](C(Cl)(Cl)Cl)Nc1[nH]ncn1
|
|
584
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
585
|
Cn1c(c(cn1)C#N)n2cccc2
|
|
586
|
CC1=C([C@@H](OC1=O)c2ccco2)c3ccco3
|
|
587
|
COC1CC2C(CC1OC)-C3CCCC4C3N(CC4)CC2
|
|
588
|
c1ccc2c(c1)C(=O)OS(=O)(=O)N2
|
|
589
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
590
|
c1c(cc(c2c1C=C(OC2)CO)O)O
|
|
591
|
CCn1c(c(nn1)C(=O)N)N
|
|
592
|
c1ccc(cc1)/C=C/c2nnc(o2)N
|
|
593
|
CC1=C2C(=N[C@@H]1c3ccncc3)CCNC2=O
|
|
594
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
595
|
c1ccc(cc1)CNc2cnccn2
|
|
596
|
CC1=Cn2c(=O)c3ccccc3c(=O)n2C1
|
|
597
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
598
|
c1ccc(c(c1)c2nnco2)O
|
|
599
|
c1c2cn[nH]c2cnc1Cl
|
|
600
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
601
|
Cc1[nH]c(cn1)C(F)(F)F
|
|
602
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
603
|
CC1=NC[C@@H](O1)c2ccccc2
|
|
604
|
c1ccc(cc1)OCc2[n-]nnn2
|
|
605
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
606
|
c1csc(n1)n2cnnc2
|
|
607
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
608
|
c1cnccc1c2ccnc3n2ncc3
|
|
609
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
610
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
611
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
612
|
c1cc2cccc3c2c(c1)NS3(=O)=O
|
|
613
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
614
|
CCOC(=O)c1c([nH]c(=O)[nH]1)C
|
|
615
|
c1ccc(cc1)n2c3c(ccc(=O)o3)cn2
|
|
616
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
617
|
|
|
618
|
CC(=O)N[C@H]1c2nc(cn2[C@@H]([C@H]([C@@H]1O)O)CO)CC(=O)[O-]
|
|
619
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
620
|
CCOC(=O)/N=c/1ccccn1[O-]
|
|
621
|
C1CCC2C(C1)-C3CCCCC3[C@H]4[C@@H]2CC(=O)O[C@@H]4C(=O)[O-]
|
|
622
|
CCOC(=O)C1=C(N=CC[C@@H]1C)C
|
|
623
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
624
|
c1cc(cc(c1)N)C2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
625
|
CSc1c(c([nH]n1)c2ccco2)C#N
|
|
626
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
627
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
628
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
629
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
630
|
c1cc(sc1)[C@@H]2CC(=O)Nc3c2cn[nH]3
|
|
631
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
632
|
C1CCC(C1)C(=O)Nc2[n-]nnn2
|
|
633
|
CC(=O)c1c(c2ccccc2o1)n3cccc3
|
|
634
|
Cc1c(oc(n1)SCC(=O)[O-])C
|
|
635
|
c1cnc(nc1c2nccs2)N
|
|
636
|
CC(=C)c1nc(co1)C(=O)[O-]
|
|
637
|
C1CCC2(CC1)C3=C(CCCC3)n4c(nc(n4)N)N2
|
|
638
|
c1cc2c(cc1F)-c3c(cno3)CS2
|
|
639
|
c1cc(cnc1)C2=NCC(=N2)C#N
|
|
640
|
c1ccc2c(c1)-c3ccccc3[S@@](=O)O2
|
|
641
|
CC1=NN(C(=O)C1)C(=O)c2ccc(cc2)O
|
|
642
|
c1ccc2c(c1)CCN3[C@@H]2Cc4c(cno4)C3=O
|
|
643
|
Cc1cc(nn2c1nnc2)n3c(nc(n3)N)N
|
|
644
|
c1ccc(cc1)OCc2nnco2
|
|
645
|
c1cc(cnc1)Cc2cnc[nH]2
|
|
646
|
CSc1nccc(n1)c2cnoc2
|
|
647
|
COC1NC-2NCCC2C3N1CCO3
|
|
648
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
649
|
CC(=CCC/C(=C/CO)/C)C
|
|
650
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
651
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
652
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
653
|
COC1=COC(=C(O1)O)C2CCC(CC2)F
|
|
654
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
655
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
656
|
CC1CC2CC(OC2C3C1C(NNC3CL)CL)C
|
|
657
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
658
|
CC1=NC2=Nc3ccccc3CN2C(=C1)O
|
|
659
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
660
|
Cc1c(n2c3c1cccc3CC2)C
|
|
661
|
CN1C(=C/C(=C/2N=NC(=[NH2+])O2)/NC1=O)[O-]
|
|
662
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
663
|
Cc1c2c(n(n1)c3ccccc3)N[C@@H](C=C2C)C
|
|
664
|
c1ccc2c(c1)cc([nH]2)c3nn4cnnc4s3
|
|
665
|
CCCCc1ncc(n1C(=O)C)COC(=O)C
|
|
666
|
COC1CC2C3C(C1)SCC(=O)N3CN2
|
|
667
|
Cc1nccn1c2c(cnc(n2)N3CCOCC3)F
|
|
668
|
c1nc([nH]n1)c2c(non2)N
|
|
669
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
670
|
C=Cn1cccc1c2ccco2
|
|
671
|
c1cc(sc1)C2=CC[C@@H](C(=O)N2)C#N
|
|
672
|
C[C@@H]1C(=N[C@@]2([C@@]1(c3ccccc3-c4c2cccc4)O)O)C
|
|
673
|
CN(CCn1cccn1)c2ccccc2
|
|
674
|
c1cc(ccc1C#N)OC(=O)c2csnn2
|
|
675
|
C=Cn1cccc1c2cccs2
|
|
676
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
677
|
CC1=Nc2nc3ccccc3n2C(=CC1)C
|
|
678
|
Cc1c(snn1)c2[nH]c3ccccc3n2
|
|
679
|
c1ccc(cc1)n2cccc2c3ccsc3
|
|
680
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
681
|
C1CCC(CC1)S(=O)(=O)C2=C[C@@H](C[C@@H]2O)O
|
|
682
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
683
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
684
|
c1ccc(cc1)COc2c(non2)N
|
|
685
|
CC(=O)N[C@@H]1C[C@@H](C=C1)C(=O)OC
|
|
686
|
Cc1cc(n(n1)CNc2nccs2)C
|
|
687
|
c12c(non1)N=C3C(=Nc4c(non4)N3)N2
|
|
688
|
CC1=CC(=O)Nc2cccc3c2n1nc3
|
|
689
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
690
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
691
|
c1c[nH]nc1C2CCCCC2
|
|
692
|
C1CC2N(C1)[C@@H](OC2=O)C3CCCO3
|
|
693
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
694
|
c1c(nnn1CC(=O)[O-])CO
|
|
695
|
C1CCCC(=CC(=O)N)CC1
|
|
696
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
697
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
698
|
CN1CCC=CC2C1CCCC2
|
|
699
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
700
|
Cc1c(c-2c(cn1)COc3c2cccc3)C#N
|
|
701
|
COC1=NC2=NCCN2C(=N1)OC
|
|
702
|
c1cc(ccc1c2ncc(cn2)O)O
|
|
703
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
704
|
CCC(=C1N(C(=O)C(=O)O1)CC)CC
|
|
705
|
c1c2c(cc3c1OCO3)-c4c(c(=O)c4=O)CC2
|
|
706
|
CC1=NC2=CC(=NC3=CC(=NC(=C1)C32)C)C
|
|
707
|
c1ccc2c(c1)Cc3ccccc3OCO2
|
|
708
|
c1ccc(cc1)CSc2ccn[nH]2
|
|
709
|
c1csc2c1C(=O)N[C@@H]3CCCCN3C2
|
|
710
|
CSc1c2c(oc(=O)c1C#N)CCC2
|
|
711
|
C1COCCN1c2nnc(o2)N
|
|
712
|
C1CCC(CC1)[C@@H]2CC(=O)OC2
|
|
713
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
714
|
Cc1c(non1)c2[n-]nnn2
|
|
715
|
CCOC(=O)c1[nH]nc(n1)N
|
|
716
|
c1ccc2c(c1)CCCN2c3c(cno3)C#N
|
|
717
|
Cn1c(ccn1)c2nnc(o2)N
|
|
718
|
[H]/N=c/nc(ss1)Oc2ccccc2
|
|
719
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
720
|
CCOC1=CC(=C(C(C1)(C)C)C(=O)OCC)C
|
|
721
|
C1CCC2C(C1)C(=O)N3CCCC3[C@@H](N2)O
|
|
722
|
CCCC[C@@H](CC)C1=NCCO1
|
|
723
|
C1CN(CCN1)C(=O)CC#N
|
|
724
|
COC(=O)c1csc2c1nns2
|
|
725
|
c1cc(=O)oc2c1cc3c(c2O)OCC3
|
|
726
|
C1CCC(CC1)CN2CCNC2C3CNCCN3
|
|
727
|
Cc1c2c([nH]n1)OC(=C([C@@H]2c3ccco3)C(=O)N)N
|
|
728
|
c1ccc2c(c1)C(=O)CCCS2
|
|
729
|
COC(=O)CC1(C(=O)NC(=O)N=C1[O-])CC(=O)OC
|
|
730
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
731
|
Cc1cc2n(c(=O)c1C#N)CCC2=O
|
|
732
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
733
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
734
|
CC1(COC2CC(CC3C2N1NN3)N)C
|
|
735
|
C1CC(CCC=C1)CCC(=O)N
|
|
736
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
737
|
c1ccc(cc1)n2cnc(n2)[O-]
|
|
738
|
c1ccc2c(c1)C(=NS2(=O)=O)n3ccnc3
|
|
739
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
740
|
CCOC(=O)c1c2n(cn1)C(OC2=O)(C)C
|
|
741
|
c1cc(oc1)c2cccs2
|
|
742
|
c1ccc2c(c1)CCC3=C2CCC(=O)N3
|
|
743
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
744
|
Cc1csc(n1)N2CCc3c2cccc3
|
|
745
|
c1ccc(c(c1)C(=O)[O-])S[C@@H]2CCC(=O)N2
|
|
746
|
c1cc(oc1)c2nnc3n2CCCCC3
|
|
747
|
Cn1cc(cn1)c2cc(on2)CO
|
|
748
|
CCOc1c(nc(o1)C#N)C
|
|
749
|
c1ccc2ccc(=O)ccc(c1)C2
|
|
750
|
c1ccc(cc1)[C@@H]2CC(=O)NC2
|
|
751
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
752
|
CC1=Nc2ccccc2[S@@](=N1)(=O)[O-]
|
|
753
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
754
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
755
|
Cn1c(nnn1)c2ccco2
|
|
756
|
c1ccc2c(c1)nc3c(noc3n2)[O-]
|
|
757
|
Cc1c2c(c3ccccc3n1)-n4cnnc4SC2
|
|
758
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
759
|
C1CC2C(CC1C3NNC(O3)N)SCN2
|
|
760
|
Cc1c(cn(n1)C)S(=O)(=O)n2cccn2
|
|
761
|
Cc1ccc(cc1)OCn2cc(cn2)N
|
|
762
|
C1COC(=CO1)c2nnc(o2)N
|
|
763
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
764
|
c1ccc(cc1)n2c(nc(n2)Cl)c3ccco3
|
|
765
|
c1ccc-2c(c1)CCCn3c2nnn3
|
|
766
|
CCOC(=O)N1C=CC=C[C@@H]1CC=C
|
|
767
|
CC(=O)N1[C@@H](CC=C[C@H]1CC=C)CC=C
|
|
768
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
769
|
c1cc(sc1)c2ccn[nH]2
|
|
770
|
|
|
771
|
CCOC(=O)/[NH+]=c/cc(cc(o1)O)O
|
|
772
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
773
|
CC(C)(C)C1CC2C(C(C1)C(=O)[O-])SOC2=O
|
|
774
|
C1CCc2c(c3c(c([nH]c3s2)C#N)N)C1
|
|
775
|
Cc1ccc(cc1)NC2=CC(=O)NC2
|
|
776
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
777
|
Cc1cn(c2c1-c3c(cno3)CC2)C
|
|
778
|
c1ccc(cc1)Nc2nnns2
|
|
779
|
c1ccc2c(c1)nc3n2-c4ccc(cc4CS3)N
|
|
780
|
Cc1c(sc(c1C(=O)[O-])n2cnnn2)C
|
|
781
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
782
|
Cn1c(cc2c1nc(nc2OC)N)C(=O)[O-]
|
|
783
|
CC1C2C(C3C(C1OC)CC(=O)O3)C(=O)OC2
|
|
784
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
785
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
786
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2ccccc2
|
|
787
|
C(CS(=O)(=O)c1c(c(nc(c1Cl)F)F)F)O
|
|
788
|
c1ccc(cc1)NC2=NC(=O)CC(=N2)[O-]
|
|
789
|
c1ccc(c(c1)C(=O)[O-])Sc2c(nccn2)Cl
|
|
790
|
Cc1cc(=O)c2c(o1)-c3ccccc3CC2
|
|
791
|
CCc1ccc(cc1)N2C(=O)CC(=O)N=C2O
|
|
792
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
793
|
COC(=O)[C@@H](c1ccco1)N
|
|
794
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
795
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
796
|
c1ccc2c(c1)-c3c4c(cccc4sn3)C2=O
|
|
797
|
CCOC1=NC(=CC(=C[C@@H]1C)C)C
|
|
798
|
CCOC(=O)n1cccc(c1=[NH2+])C
|
|
799
|
CCSC1NC(CS1)C
|
|
800
|
CC1=C([C@@H](C1)C(=O)N)C(=O)N
|
|
801
|
CC[C@@]1(C(=N1)N(C)C)C2CCCCC2
|
|
802
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
803
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
804
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
805
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
806
|
c1cc(c2c(c1)SCc3ccsc3C2=O)N
|
|
807
|
CCCC[C@@H](CC)C(=O)N1CCN=C1C
|
|
808
|
c1ccc2c(c1)-c3cccnc3C2=O
|
|
809
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
810
|
c1ccc(cc1)c2ccc(nn2)n3cnnc3
|
|
811
|
c1ccc2c(c1)c(=O)cc3n2CC(=O)O3
|
|
812
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
813
|
CCS(=O)(=O)NCCn1cccn1
|
|
814
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
815
|
Cc1cc(no1)[C@@H]2CCCN2c3ncccn3
|
|
816
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
817
|
CCOC(=O)N1c2ccccc2O[C@@H]1C#N
|
|
818
|
c1c(=O)nc2n3c1NC(=O)Cc3cs2
|
|
819
|
c1csc2c1C(=O)[C@H]3C=CC=CC3=CC2=O
|
|
820
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
821
|
C1CCC(C1)c2nnc(o2)N
|
|
822
|
c1ncn(n1)CCn2cncn2
|
|
823
|
CCc1nc(cs1)Cn2ccccc2=O
|
|
824
|
Cc1c2c(on1)COc3ccccc3C(=O)C2
|
|
825
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
826
|
c1cnccc1N2C(=O)C3=C(S2(=O)=O)CCCC3
|
|
827
|
c1cc(oc1)c2cc(no2)CO
|
|
828
|
C[C@@H]1CC(n2c3c1cccc3oc(=O)c2=O)(C)C
|
|
829
|
CCOC(=O)Cn1nnnn1
|
|
830
|
c1ccc2c(c1)CCC(=C2)S(=O)(=O)N
|
|
831
|
CC1=N/C(=C/c3ccccc3C(=O)O2)/C(=O)O1
|
|
832
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
833
|
c1ccc(cc1)[C@@H]2COC(=O)N2
|
|
834
|
CCn1c(ccn1)SCC(=O)[O-]
|
|
835
|
CCCCC1C(OC(N1)C)CC=C
|
|
836
|
c1cc(sc1)C(=O)/C=C/2C(=O)NCCN2
|
|
837
|
CCCC1=NCCn2c1ccc2
|
|
838
|
CS(=O)(=O)Nn1cnnc1
|
|
839
|
Cc1c(c(=O)cco1)OS(=O)(=O)c2ccccc2
|
|
840
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
841
|
CC1=Nn2c(nnc2N=C(C1)O)N
|
|
842
|
Cc1cc2c(o1)ccc3c2non3
|
|
843
|
|
|
844
|
c1cc(sc1)C(=O)c2[nH]ccn2
|
|
845
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
846
|
c1ccc2c(c1)OS(=O)(=O)CS(=O)(=O)O2
|
|
847
|
Cc1c2c([nH]c1C(=O)C)CCCC2=O
|
|
848
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
849
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
850
|
c1ccc(cc1)C2=NS(=O)(=O)Nc3c2cccc3
|
|
851
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
852
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
853
|
c1ccc2c(c1)nc(c3n2ccc3)n4cccc4
|
|
854
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
855
|
CCOC(=O)C=C1CCOCC1
|
|
856
|
[H]/N=C/1CC(=O)N=C2N1N=C(S2)CCC
|
|
857
|
c1csc-2c1S(=O)(=O)c3c2scc3
|
|
858
|
c1ccc(cc1)n2c3c(cn2)c(ncn3)N
|
|
859
|
c1cc2c3c(c1)OCc3cc(=O)o2
|
|
860
|
CNC(=O)N/C=C/c1ccco1
|
|
861
|
c1ccn(c1)c2ccnc(n2)c3cccnc3
|
|
862
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
863
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
864
|
c1ccc2c(c1)CCO[C@@H]2C#N
|
|
865
|
CC(=O)C1=C(c2ccccc2S(=O)(=O)N1)[O-]
|
|
866
|
Cc1c(c(n(n1)Cc2[n-]nnn2)C)Br
|
|
867
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
868
|
c1cc(oc1)c2nccs2
|
|
869
|
c1ccc(cc1)N2CCC(=O)C2
|
|
870
|
c1cc(ccc1[C@@H](c2ccns2)O)F
|
|
871
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
872
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
873
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
874
|
C[C@@H](c1ccno1)Oc2ccccc2
|
|
875
|
Cn1c2ccccc2c3c1c(=O)cc(o3)CO
|
|
876
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
877
|
C1CCC2C(C1)CCN3[C@@H]2CCC4=C3CNC4=O
|
|
878
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
879
|
CC1=CC(=Nn2c(nnn2)N1)C
|
|
880
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
881
|
CC(=O)c1coc(cc1=O)O
|
|
882
|
COc1ccc2c(c1O)[C@@H]3CCC=CC3=C2
|
|
883
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
884
|
Cc1cc(c(c(c1)C)OS(=O)(=O)n2cncn2)C
|
|
885
|
CC(=O)NC1=C(c2ccccc2C1)S(=O)(=O)[O-]
|
|
886
|
c1c[nH]nc1C(=O)NC2CC2
|
|
887
|
Cc1cc(sn1)NS(=O)(=O)c2ccc(cc2)N
|
|
888
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
889
|
COC(=O)CCc1c[nH]cn1
|
|
890
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
891
|
C1CCn2c(nnn2)[C@@H](C1)C(=O)[O-]
|
|
892
|
c1cc(ccc1C#N)OC(=O)Cc2ccsc2
|
|
893
|
c1ccc(cc1)c2cc(=O)c2=O
|
|
894
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
895
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
896
|
CC1(C[C@@H](C(=O)C1)[C@@]23COC(=O)C(=C2C=C3)CO)C
|
|
897
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
898
|
CC1C(NN2C(NC(C2N1)C(=O)N)C)C
|
|
899
|
C1CC(OC1)C2C3C(CNNC3OC2C4CCCO4)N
|
|
900
|
CCC(=O)Oc1c(noc1C)C
|
|
901
|
Cc1c(c(c([nH]1)C)C(=O)[O-])c2nnc(o2)C
|
|
902
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
903
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
904
|
c1cc(cc(c1)N)CC(=O)[O-]
|
|
905
|
COC(=O)CC1=NCCOC1=O
|
|
906
|
CC1=CC(=O)O[C@@H]1CC(=O)[O-]
|
|
907
|
c1ccc2c(c1)c(=O)c-3nc(=O)nc23
|
|
908
|
c1ccc(cc1)n2c(noc2=O)c3cccnc3
|
|
909
|
Cc1csc(n1)c2cc3ccccc3oc2=O
|
|
910
|
c1ccc2c(c1)c(=O)n3n2C[C@@H](C3)O
|
|
911
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
912
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
913
|
COC(=O)c1ccc(o1)C#N
|
|
914
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
915
|
CN1CCc2c1cc(c3c2N(CC3)C)c4ccco4
|
|
916
|
Cc1c(sc(n1)C)c2cc[nH]n2
|
|
917
|
Cc1nc(cs1)c2nnc(o2)N
|
|
918
|
COC1CC2C3C(C1)SCC(=O)N3NN2
|
|
919
|
C/C=c/c(cc(n/c1=C(C)/O)C)n2cncn2
|
|
920
|
c1ccc2c(c1)Cc3ccccc3S2
|
|
921
|
Cc1ccc(cc1)Nc2[nH+]c(=O)cc(s2)C
|
|
922
|
c1cc2c(cc(=O)oc2cc1O)N
|
|
923
|
c1ccc2c(c1)oc(=O)c(=O)o2
|
|
924
|
c1ccc(cc1)C2=CC(=O)OC2
|
|
925
|
C1CCC2C(C1)C=CC=CS2(=O)=O
|
|
926
|
CN1c2ccccc2C(=O)N3C1=NCC3
|
|
927
|
c1cc2cn[nH]c2cc1C3=CCOCC3
|
|
928
|
c1cc(oc1)c2ccnc(n2)N
|
|
929
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
930
|
CC1=NC(=O)[C@H](C=C1C(=O)C)C#N
|
|
931
|
c1cc(oc1)CNc2[n-]nnn2
|
|
932
|
C1C[C@@H](OC1)COCCC#N
|
|
933
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
934
|
c1c(noc1N)C2CCCC2
|
|
935
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
936
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
937
|
Cc1cccc(c1N2CCc3c2[nH][nH+]c3)C
|
|
938
|
c1ccc2c(c1)NC=CN2CCO
|
|
939
|
[H]/N=C/NC(=C2[C@@H]([C@@H](C(=O)N=C2N1)C#N)c3ccccc3)[O-]
|
|
940
|
C1CCC2C(C1)OC[C@@H](CS2)O
|
|
941
|
CC1=C([C@@H]2CCO[C@@H]2O1)C(=O)OC
|
|
942
|
c1cc2c(cc1N)c3c(c(=O)o2)NCCC3
|
|
943
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
944
|
C1CCC2C(C1)OC(=C(O2)C(=O)[O-])C(=O)[O-]
|
|
945
|
c1cc(sc1)CC(=O)n2cnnc2
|
|
946
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
947
|
c1cc2cc(sc2nc1)CO
|
|
948
|
|
|
949
|
COc1cc(nc(n1)Oc2ccccc2c3ccno3)OC
|
|
950
|
Cc1cccc2c1Oc3c(c(nn3c4ccccc4)N)C2
|
|
951
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
952
|
c1ccc(cc1)NC(=O)C(=N2=CC=CC=C2)C#N
|
|
953
|
Cc1cc(sc1CC#N)C
|
|
954
|
CC(=C1N2c3ccccc3S[C@@H]2C(C(=O)O1)(C)C)C
|
|
955
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
956
|
CC[C@@H](C(=O)N1CCC=CC1)Nc2cccc(c2)OC
|
|
957
|
Cc1cc(no1)Nc2c3ccccc3nc4c2cccc4
|
|
958
|
C/C(=C/1CCOC1=O)/NC(=O)C
|
|
959
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
960
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
961
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
962
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
963
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
964
|
C[C@@H]1C=Cc2cc(ccc2O1)O
|
|
965
|
CC1=C([C@@H](N2C(=N1)NC=N2)c3ccccn3)C(=O)N
|
|
966
|
c1cc2c(cc1O)COC2=O
|
|
967
|
c1ccc(cc1)[C@@H]2CC(=O)Nc3c2snc3C(=O)[O-]
|
|
968
|
c1c2cc(oc2ncc1F)CO
|
|
969
|
C1=N[C@@H]2C(=N1)N=C(N=C2Cl)N
|
|
970
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
971
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
972
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
973
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
974
|
c1ccc2c(c1)n(c(=O)o2)Cc3ccon3
|
|
975
|
c1ccc(cc1)N2CCC(=O)NCC2
|
|
976
|
c1ccc(cc1)C2=C(OCCO2)c3ccccc3
|
|
977
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
978
|
c1cc2c(c(c1)F)N3CCC[C@@H]3[C@@]4(C2)C(=O)COC4=O
|
|
979
|
c1ccc2c(c1)C3=NCCCN3C2=O
|
|
980
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
981
|
CC(=O)N[C@@H]1[C@@H]([C@@H]([C@@H](O[C@@H]1OC)CO)O)O
|
|
982
|
Cc1nc-2n(n1)CC(=Nc3c2cccc3)O
|
|
983
|
Cc1ccc(c2c1C3=C(S2(=O)=O)CCCC3)C
|
|
984
|
C[C@@H]1Cc2c3c(cccc3N1)ncn2
|
|
985
|
c1cnc2c(n1)cc(s2)C(=O)[O-]
|
|
986
|
Cn1ccc(n1)c2cc(nc3n2c4ccccc4n3)[O-]
|
|
987
|
C[C@@H]1C=CN(c2n1ncc2C(=O)[O-])C
|
|
988
|
C1CCC(C(C1)NC2[NH+]C(C(N2O)[O-])N)F
|
|
989
|
CC(=O)N1Cc2c([nH]cn2)C[C@H]1C(=O)OC
|
|
990
|
C1C[C@@H](OC1)c2nnc(o2)N
|
|
991
|
|
|
992
|
Cc1nc(cs1)c2cc(no2)CO
|
|
993
|
c1cc(oc1)CNc2nnns2
|
|
994
|
c1c(nc(=O)n(n1)[C@@H]2CCCO2)N
|
|
995
|
C1CCN(C1)c2c(c(ns2)Cl)C#N
|
|
996
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
997
|
Cc1cc(no1)c2nnc(o2)N
|
|
998
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
999
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
1000
|
C1CCC(CC1)C2(CN3CCOC3=N2)C4CCCCC4
|
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