(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
2
|
C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](N2C(=O)N1)O)O)O)O
|
|
3
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
4
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
5
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
6
|
CC1C(NC2C(N1)C(NNC2N)N)C
|
|
7
|
Cc1c2c([nH]n1)NC3=C([C@@H]2C)C(=O)OC3
|
|
8
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
9
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
10
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
11
|
CNC1C2C(C3CCCCC3S2)NNN1
|
|
12
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
13
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
14
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
15
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
16
|
c1ccc2c(c1)c-3c4c(nc(=[NH2+])c3c(o2)O)CCCCC4
|
|
17
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
18
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
19
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
20
|
Cc1cc(nc2c1c(c(o2)C(=O)C)N)C
|
|
21
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
22
|
|
|
23
|
c1cnnc(n1)c2nccnn2
|
|
24
|
c1ccc(cc1)c2cnn3c(n2)nnn3
|
|
25
|
c1ccc2c(c1)c3cn[nH]c(=O)c3[nH]2
|
|
26
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
27
|
c1ccc2c(c1)-c3ccccc3NC(=O)N2
|
|
28
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
29
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
30
|
Cc1nc-2n(n1)CC(=Nc3c2cccc3)O
|
|
31
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
32
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
33
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
34
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
35
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
36
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
37
|
C1CNC([NH]1)S[C@@H]2[C@H]([C@@H]([C@@H](CO2)O)O)O
|
|
38
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
39
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
40
|
CC(=O)NCCc1coc2c1ccnc2
|
|
41
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
42
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
43
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
44
|
C1C(C(NCN1)N)CCC2OCCO2
|
|
45
|
c1ccc(cc1)[C@@H]2CNC(=O)N2
|
|
46
|
CCCC1=C([C@@H](n2c(ncn2)N1)C)C(=O)OCC
|
|
47
|
C[C@@H](c1ccn[nH]1)Oc2ccccc2
|
|
48
|
Cc1c2c(onc2c(=O)[nH]n1)C
|
|
49
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
50
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
51
|
c1ccc2c(c1)nc3n2-c4ccc(cc4CS3)N
|
|
52
|
C1CCC2C(C1)-C3CNCNC3N=C(N2)N4CCCCC4
|
|
53
|
|
|
54
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
55
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
56
|
C1CC2C3C(C(NNN3)[O-])SC2NC1
|
|
57
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
58
|
|
|
59
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
60
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
61
|
|
|
62
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
63
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
64
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
65
|
Cc1c(c2c3nnc(n3cnc2o1)C)C(=O)[O-]
|
|
66
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
67
|
CC=NC2CCCCC2/C1=C/3C4CCCCC4C(=O)NN3
|
|
68
|
C[C@@H]1c2cccn2CCN1c3c4cn[nH]c4nc(n3)N
|
|
69
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
70
|
c1ccc2c(c1)c(c3ccccc3n2)Nn4cnnc4
|
|
71
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
72
|
CSc1nnc(s1)CSc2[nH]ncn2
|
|
73
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
74
|
CCCCOC1=N[C@@H]2[C@@H](CNC2=O)CO1
|
|
75
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
76
|
Cc1ccc2c(c1)nnc(n2)N
|
|
77
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
78
|
C1CCC(CC1)C2C(C3CNCCC3O2)C#N
|
|
79
|
CC(=O)Nc1c(c2c(s1)CCCC2)c3nsc(=O)o3
|
|
80
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
81
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
82
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
83
|
c1ccc(cc1)c2c([nH]c(=O)[nH]2)C(=O)[O-]
|
|
84
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
85
|
Cc1cc2cccc(c2o1)n3cnnn3
|
|
86
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
87
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
88
|
C1CN2C=Nc3c(c(no3)C(=O)[O-])C2=N1
|
|
89
|
C1[C@@H]2[C@H]([C@@H]([C@@H]([C@@H](N2S(=O)(=O)N1)O)O)O)O
|
|
90
|
Cc1c(c2c(s1)c(=O)[nH]nn2)C(=O)[O-]
|
|
91
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
92
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
93
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
94
|
c1ccc(cc1)n2c3c(cn2)c(nnn3)[O-]
|
|
95
|
Cc1ccc(n1c2cnccn2)C
|
|
96
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
97
|
CCn1c2c(c(n1)C)NC(=O)CNC2=O
|
|
98
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
99
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
100
|
CCOC=C(c1nnco1)c2nnco2
|
|
101
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
102
|
c1ccc2c(c1)nnn2c3nnns3
|
|
103
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
104
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
105
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
106
|
|
|
107
|
C[C@@]1(C[C@@H](NN2C3CCCCC3C4C2C1CCC4)CO)CO
|
|
108
|
CC(C)(C)c1cnnc(n1)N
|
|
109
|
c1c(=O)nc2n3c1NC(=O)Cc3cs2
|
|
110
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
111
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
112
|
c1ccc(cc1)c2c3c(non3)on2
|
|
113
|
C=c1cc(n-2/c(=Cc3ccncc3)/c(=O)nc2[nH]1)[O-]
|
|
114
|
Cc1c(n2c(c1C#N)NC(=O)CCC2)C
|
|
115
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
116
|
|
|
117
|
Cn1c(=O)c(nn(c1=O)c2ccccc2)c3nc(on3)[O-]
|
|
118
|
c1nc-2c3nc(on3cnc2n1)[O-]
|
|
119
|
CCC(=O)n1c2ccccc2c3c1Nc4ccccc4N3
|
|
120
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
121
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
122
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
123
|
CC1(Cc2c(sc(=O)nc2N)C1)C
|
|
124
|
c1ccc2c(c1)nnn2c3cnns3
|
|
125
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
126
|
CC1=CC(=O)Nc2ccccc2N1
|
|
127
|
Cc1csc(n1)c2cn[nH]c2N
|
|
128
|
c1ccc-2c(c1)-c3c2cc(cc3)N
|
|
129
|
CCCC(=O)/[NH+]=c/cc(c-2c(oc3ccccc3c2n1)O)C
|
|
130
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
131
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
132
|
c1ccc(cc1)C(=O)c2c(non2)N
|
|
133
|
COc1ccccc1n2ccnc(c2=O)N
|
|
134
|
Cc1cc([nH]n1)OCCC#N
|
|
135
|
C=CC[C@@H]1C(=NC(=NC1=O)N)O
|
|
136
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
137
|
Cc1c(c2c(o1)CCC2=O)C(=O)[O-]
|
|
138
|
[H]/N=C/N[C@@]2(c3ccccc3C(=O)[C@]2(N1)O)O
|
|
139
|
CCOc1c(c(=O)c1=O)Nc2ccccc2
|
|
140
|
|
|
141
|
COc1c2cn[nH]c2ncn1
|
|
142
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
143
|
c1(c(non1)N)c2nnc(o2)N
|
|
144
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
145
|
c1ccc2c(c1)c3c(=O)[nH]ncn3n2
|
|
146
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
147
|
Cc1cc2c(o1)ccc3c2non3
|
|
148
|
c1ccc2c(c1)n3c(o2)[nH+]c(nc3=O)N
|
|
149
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
150
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
151
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
152
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
153
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
154
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
155
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
156
|
Cc1c2c(c(oc2ncn1)c3ccco3)c4ccco4
|
|
157
|
c1cc(cnc1)c2cc([nH]n2)N
|
|
158
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
159
|
CCN1CCC2C1NCNC2N
|
|
160
|
c1ccc(cc1)COc2c(non2)N
|
|
161
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
162
|
COC(=O)c1c2c3c(nsc3s1)SCC(=N2)O
|
|
163
|
c1cc(cnc1)N2CC[C@H]3C[NH2+][C@H]3C2
|
|
164
|
c1ccc2c(c1)CNC(=O)CN2
|
|
165
|
c1c2cc(nc(c2c(nc1O)O)O)O
|
|
166
|
|
|
167
|
c1ccc2c(c1)c3c(cc(s3)C(=O)[O-])c(=O)o2
|
|
168
|
C1Cc2c(nn(c2N)CCC#N)C1
|
|
169
|
c1cc(sc1)C(=O)n2cnnc2N
|
|
170
|
c1cc(oc1)c2ccnc(n2)N
|
|
171
|
c1ccc2c(c1)c3n(c(=O)n2)CC(=O)N3
|
|
172
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
173
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
174
|
CC(=O)Nc1ccc(c2c1n(cn2)C(=O)C)OC(=O)C
|
|
175
|
Cc1nnnn1C2CCCCC2
|
|
176
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
177
|
c1cc2c(cc1c3cc[nH]n3)CCC2
|
|
178
|
CC1CC2CC3CCCNN3C2NN1
|
|
179
|
CC(=O)n1c(c(nn1)CC#N)c2ccccc2
|
|
180
|
CSC1C2C3C(C(NNN3)CL)SC2NS1
|
|
181
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
182
|
c1ccc2c(c1)-c3c(nc4nnnn4n3)C2=O
|
|
183
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
184
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
185
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
186
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
187
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
188
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
189
|
|
|
190
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
191
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
192
|
c1cnnc2c1-c3c(non3)CC2
|
|
193
|
c1ccc2c(c1)Nc3cc(nnc3S2)Cl
|
|
194
|
CN(C)c1nnnn1c2ncccn2
|
|
195
|
C1CCC2C(C1)CC[C@@H]3[C@@H]2NC3=O
|
|
196
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
197
|
c1ccc2c(c1)C[C@@H]3CC[C@@H](C3=N2)O
|
|
198
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
199
|
CC1=Nc2c(c(nc(n2)N3CCCCC3)N)C1=O
|
|
200
|
c1ccc2c(c1)nnn2C3=CCCO3
|
|
201
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
202
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
203
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
204
|
c1ccc(cc1)Cc2c(nccn2)N
|
|
205
|
c1cc(cnc1)NCc2csnn2
|
|
206
|
c1ccc-2c(c1)CSc3c2[nH]nc3O
|
|
207
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
208
|
Cc1cc(=O)n2n1c3ccccc3nn2
|
|
209
|
[H]/N=c/[nH]c-2c(s1)-c3cccc4c3c2ccc4
|
|
210
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
211
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
212
|
CC[C@@H](C(=O)/N=C/1N=CN=N1)Oc2ccccc2
|
|
213
|
CCOc1cc2c(cc1F)nnc(n2)C
|
|
214
|
c1coc(=O)c2c1n3c(nc2)ncn3
|
|
215
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
216
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
217
|
CC1(Cc2c(c(sc2c3cc[nH]n3)SC)C(=O)C1)C
|
|
218
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
219
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
220
|
CC1(c2cccnc2NC1=O)C
|
|
221
|
c1cc(cnc1)CCNCc2cscn2
|
|
222
|
CCn1c(c(nn1)C(=O)N)N
|
|
223
|
c1ccc2c(c1)C(=O)[C@@]3([C@@]2(Nc4c(non4)N3)O)O
|
|
224
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
225
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
226
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
227
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
228
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
229
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
230
|
CC(C)(C)OC(=O)N1c2cscc2-c3cccnc3[C@@H]1O
|
|
231
|
c1cc2c(nc1)Nc3c(c(=O)nc([nH]3)N)S2
|
|
232
|
Cn1c2c(cn1)nc[nH]c2=O
|
|
233
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
234
|
CCOC(=O)/[NH+]=c/cc(cc(o1)O)O
|
|
235
|
CCOc1c(c([nH]n1)N)C#N
|
|
236
|
Cc1c(n2ccccc2n1)c3ccn[nH]3
|
|
237
|
CC1(COC2CC(CC3C2N1NN3)N)C
|
|
238
|
c1ccc2c(c1)nc(c3n2nnn3)N
|
|
239
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
240
|
C1CC2C(CC1CL)C3C(C(=O)O2)OCCN3
|
|
241
|
c1cc(sc1)c2nn(c(=O)n2c3ccncc3)CCC#N
|
|
242
|
c1ccc(cc1)c2cncnc2
|
|
243
|
c1ccc(cc1)NCn2cncn2
|
|
244
|
c1c[nH]c2c1c(=O)[nH]c(n2)N
|
|
245
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
246
|
c1c(cn[nH]c1=O)N2CCCC2
|
|
247
|
c1cc2c3c(c1)NC(=O)C4=C(N3CCC2)CCC4
|
|
248
|
COC(=O)c1cc(=O)nc(s1)N
|
|
249
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
250
|
c1cc(ccc1N2C3=CCCCC3=C(C2=O)O)Cl
|
|
251
|
Cc1nc(nn1C)NC(=O)NCc2ccon2
|
|
252
|
c1cc2c(c(c1)F)c(nc3n2nnc3C#N)N
|
|
253
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
254
|
c1c2c(c3c(c1Br)non3)nno2
|
|
255
|
c1c(nc[nH]1)C[C@@H]2C(=O)N3CCC[C@@H]3C(=O)N2
|
|
256
|
CCCO[C@@H]1CCCN(C1)C(=O)c2ccnnc2
|
|
257
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
258
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
259
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
260
|
Cc1c2nc3ccccc3n2c(=O)[nH]n1
|
|
261
|
Cn1c(=O)c2ccccc2c(n1)c3ccc(cc3)O
|
|
262
|
Cn1c(cc(=O)n(c1=O)C)c2nnc(o2)N
|
|
263
|
c1ccn(c(=O)c1)OCC(=O)[O-]
|
|
264
|
c1c(cnc2c1non2)Br
|
|
265
|
c1ccc2c(c1)n3c(=O)c(=O)[nH]nc3s2
|
|
266
|
Cc1nnc(o1)Nc2ccccc2
|
|
267
|
CN1C(=O)C(=C(C12CCCC2)N)C(=O)N
|
|
268
|
C1CC[C@@H]2[C@@H](C1)NC(=O)C(=N2)CCC(=O)[O-]
|
|
269
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
270
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
271
|
Cc1c(c(n[nH]1)O)C2=NCCCCC2
|
|
272
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
273
|
c1ccc(cc1)N2CCNC2=O
|
|
274
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
275
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
276
|
c1ccc(cc1)c2cnns2
|
|
277
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
278
|
c1ccc2c(c1)-c3c[nH]c4c3c(ccc4)C2=O
|
|
279
|
Cc1cnc(nc1c2ncnn2C)N
|
|
280
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
281
|
C1CNC(NC1C(F)(F)F)N2CCNC2
|
|
282
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
283
|
Cc1c(non1)NCn2cnnn2
|
|
284
|
c1cnc(nc1c2cnccn2)N
|
|
285
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
286
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
287
|
c1ccc(cc1)[C@@H]2C(=O)NC(=O)O2
|
|
288
|
c1ccc2c(c1)N=C(CN2C(=O)NCC(=O)[O-])O
|
|
289
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
290
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
291
|
c1ccc(cc1)NC(=O)Nc2nc[nH]n2
|
|
292
|
c1ccc2c(c1)Nc3c(cc(nn3)Cl)S2
|
|
293
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
294
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
295
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
296
|
c1cc2=CC=CNc2c3c1=CC=CN3
|
|
297
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
298
|
c1ccc(cc1)SCc2cc(=O)c(co2)O
|
|
299
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
300
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
301
|
c1ccc(cc1)Cc2cc(=O)[nH]cn2
|
|
302
|
c1cc(c2c(c1)SCc3ccsc3C2=O)N
|
|
303
|
c1csc2c1n3cn[nH]c(=O)c3c2
|
|
304
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
305
|
c1ccc2c(c1)Cn3c(cnn3)C=N2
|
|
306
|
c1cc2c(c(c1)O)nnn2[O-]
|
|
307
|
c1ccc2c(c1)[N-]C3=NC(=O)C(=O)N23
|
|
308
|
Cn1c(ccn1)c2nnc(o2)N
|
|
309
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
310
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
311
|
Cc1cn(c2c1-c3c(cno3)CC2)C
|
|
312
|
c1cc(oc1)C2=CC(=O)Nc3c(non3)N2
|
|
313
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
314
|
Cc1c(cco1)c2nnc(o2)N
|
|
315
|
c1ccc2c(c1)-c3nc4ccccc4n3[C@H](N2)c5ccco5
|
|
316
|
c1c(c(sc1Cl)Cl)C2=NCCNC2=O
|
|
317
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
318
|
c1cc(oc1)c2nc([nH]n2)N
|
|
319
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
320
|
c1ccc2c(c1)c3c(c(=O)o2)nc[nH]3
|
|
321
|
CC(C)(C)OC(=O)N1Cc2c(nc[nH]2)C1
|
|
322
|
CCc1cnnn1c2c(non2)N
|
|
323
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
324
|
c1cc(c2c(c1)[nH]c(=O)o2)N
|
|
325
|
c1cc2c(c(c1)F)c(no2)N
|
|
326
|
Cc1coc2c1c(=O)[nH]cn2
|
|
327
|
Cn1c2cccc3c2c(n1)-c4ccccc4C3=O
|
|
328
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
329
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
330
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
331
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
332
|
Cc1c(=O)n2c(nn1)sc(n2)c3ccco3
|
|
333
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
334
|
C[C@@H]1CCCC2=C1[C@@H](C3C(CCCC3N)[C@@H]2O)O
|
|
335
|
c1ccc-2c(c1)-c3cccc4c3c2cnc4
|
|
336
|
c1c(cn[nH]1)C23CC4CC(C2)CC(C4)C3
|
|
337
|
c1c[nH]c2c1c(cc(c2)F)N
|
|
338
|
c1ccc2c(c1)C(=O)OCC(=O)N2
|
|
339
|
Cc1c(snn1)c2cc(nc(n2)SC)[O-]
|
|
340
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
341
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
342
|
C1CCC2C(C1)C(=O)N3CCCC3[C@@H](N2)O
|
|
343
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
344
|
Cc1c(non1)NC(=O)OC[C@@H]2CCCO2
|
|
345
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
346
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
347
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
348
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
349
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
350
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
351
|
c1ccc2c(c1)c3c(c(no3)N)c(=O)[nH]2
|
|
352
|
c1cc2c([nH]nc2Cl)nc1
|
|
353
|
c1cc([nH]c1)c2ccnc3n2cnn3
|
|
354
|
Cc1c(cc2cc[nH]c2n1)C#N
|
|
355
|
CC1NCC2N1C=CN([C@@H]2O)C(=O)C
|
|
356
|
c1ccc(cc1)S(=O)(=O)CCn2cnc(n2)C#N
|
|
357
|
Cc1ccc(cc1)c2[n-]nnn2
|
|
358
|
CN(C)c1ccnc(c1C#N)Nn2cnnc2
|
|
359
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
360
|
CC1(Nc2c(c3c(s2)CCCC3)-c4n1nnn4)C
|
|
361
|
Cc1c2cnn(c2c(nn1)[O-])C(C)(C)C
|
|
362
|
C1CC2C(CC1C3NNC(O3)N)SCN2
|
|
363
|
CCOC(=O)C1=C(C(=O)NCC1)[O-]
|
|
364
|
COc1c2cc[nH]c2[nH]c(=O)n1
|
|
365
|
|
|
366
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
367
|
c1ccc(cc1)c2c3c(c(ncn3)[O-])sn2
|
|
368
|
c1cc2c(ccc3c2nno3)c(c1)S(=O)(=O)[O-]
|
|
369
|
c1c2c(n[nH]c1=O)CCOC2
|
|
370
|
Cc1cc(c(nn1)N)C(=O)N
|
|
371
|
CC1=Cc2c(ccc3c2non3)N(C1)C
|
|
372
|
CCOC(=O)/C=C/1CC(=O)Nc2c(non2)N1
|
|
373
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
374
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
375
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
376
|
c1ccc-2c(c1)CCCn3c2nnn3
|
|
377
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
378
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
379
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
380
|
c1ccc(cc1)NCC(=O)[O-]
|
|
381
|
Cc1c(c([nH]n1)[O-])Oc2ccccc2
|
|
382
|
Cc1cc(on1)c2c(n(c(=O)n(c2=O)C)C)O
|
|
383
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
384
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
385
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
386
|
|
|
387
|
CN(CCO)c1cnccn1
|
|
388
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
389
|
C[C@@H]1Cn2c(cc3c2c(ccc3)O1)C(=O)[O-]
|
|
390
|
C1CCC2C(C1)C(=O)N3C(S2)NC(N3)N
|
|
391
|
Cc1nc-2c(n1O)CCc3c2non3
|
|
392
|
Cn1ccc(n1)c2cc(nc3n2c4ccccc4n3)[O-]
|
|
393
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
394
|
CN1c2ccc(cc2-c3n[nH]c(=O)c(=O)n3CC1=O)Cl
|
|
395
|
c1ccc2c(c1)nc(o2)c3c[nH]nc3
|
|
396
|
c1ccc(cc1)CCc2cnccn2
|
|
397
|
Cc1c2c(on1)CCOC(=O)N2
|
|
398
|
c1cnccc1c2nnn(n2)CC#N
|
|
399
|
Cc1[nH]cc(n1)c2ccccc2
|
|
400
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
401
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
402
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
403
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
404
|
c1cocc1c2nc([nH]n2)N
|
|
405
|
Cc1conc1n2c(=O)nc3ccccc3n2
|
|
406
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
407
|
CC(C)NC(=O)CSc1nnns1
|
|
408
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
409
|
CC(=O)OCC1C(C(=O)C1=O)C2CCCCC2
|
|
410
|
c1cc2cc(n3c2c(c1)SCC3)C(=O)[O-]
|
|
411
|
c1cc2c(c3c1nncc3)non2
|
|
412
|
c1cc(cc(c1)N)c2cocn2
|
|
413
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
414
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
415
|
C1CCC2C(C1)C3=NC4CCNCC4CN3C2=O
|
|
416
|
C1C2CC3CC1CC(C2)(C3)c4nsc(=O)o4
|
|
417
|
c1ccc-2c(c1)CCNc3c2cccc3
|
|
418
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
419
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
420
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
421
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
422
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
423
|
|
|
424
|
Cn1c2c(cn1)NC(=O)NS2(=O)=O
|
|
425
|
c1cc(oc1)CNc2[n-]nnn2
|
|
426
|
Cc1c(c(c([nH]1)C)C(=O)OC)c2cc[nH]n2
|
|
427
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
428
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
429
|
CN1C2C(CN1)C(NNN2)[O-]
|
|
430
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
431
|
CC(=O)c1ccc2nnnn2c1
|
|
432
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
433
|
Cc1cc(=O)n2c3c1ccc(c3OC2)N
|
|
434
|
c1[nH]c2c(n1)NC(=O)CNC2=O
|
|
435
|
c1cc(c2c(c1)OC(O2)(F)F)c3c[nH]cc3C#N
|
|
436
|
C1CCC2C(C1)C[C@@H]3[C@@H]2C4CCCCC4N3
|
|
437
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]nc3
|
|
438
|
c1ccc2c(c1)-c3c4c(cccc4sn3)C2=O
|
|
439
|
COC1=C(COC1=O)CC2CCCCC2
|
|
440
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2nc(s3)C
|
|
441
|
c1ccc2c(c1)-c3ccccc3C24CNC(=O)O4
|
|
442
|
C[C@@H]1[C@H]([C@@H]([C@@H]([C@@H](O1)N)O)O)O
|
|
443
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
444
|
CCN1C(NN2C(C1=O)NC3CCCCC3C2=O)C
|
|
445
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
446
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
447
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
448
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
449
|
C1CCN(C1)c2c(non2)[O-]
|
|
450
|
C=c1/c(=C/c2ccccc2O)/c(=O)o[nH]1
|
|
451
|
c1cc(n2c1c(ncn2)N)Br
|
|
452
|
Cc1nnc(s1)N2CCOC2=O
|
|
453
|
C1c2nnnn2Cc3n1nnn3
|
|
454
|
c1cc(oc1)c2nnc3n2nc(cc3)Cl
|
|
455
|
C1CCC2C(C1)C(=O)N-3C(N2)CSC4C3CCCC4
|
|
456
|
Cc1cc(nc2c1c(on2)N)C
|
|
457
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
458
|
C1CCC2C(C1)C(NO2)C[S@@](=N)(=O)[O-]
|
|
459
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
460
|
C[C@@H](c1cccs1)NC2=NC(=O)CN2C
|
|
461
|
c1ccc2c(c1)-c3ccccc3S(=O)(=O)N2
|
|
462
|
C1C(C(C2C(C1F)N[NH]N2)N)F
|
|
463
|
Cc1cc(=O)oc2c1sc3c2cccc3
|
|
464
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
465
|
Cc1cc(on1)n2c(=O)c3ccccc3nn2
|
|
466
|
C=CCNc1cn[nH]c(=O)n1
|
|
467
|
c1ccc2c(c1)C(=O)c3c(cc4c(c3C2=O)NCCN4)O
|
|
468
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
469
|
Cn1cnc2c(c1=O)n(nc2C(=O)[O-])c3ccc(cc3)F
|
|
470
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
471
|
CC1=CC(=O)Nc2cccc3c2n1nc3
|
|
472
|
c1ccc2c(c1)nnn2C3=NCCCC3
|
|
473
|
c1cc2c(c(c1N)N)non2
|
|
474
|
Cc1[nH]c(=O)c2c3c(c(=O)oc2n1)nns3
|
|
475
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
476
|
c1ccc2c(c1)-c3c(cn[nH]3)CC(=O)N2
|
|
477
|
Cc1c(c(n[nH]1)O)CCC#N
|
|
478
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
479
|
c1ccc2c(c1)ccc3c2c4c(o3)cno4
|
|
480
|
C1CC2C(NC1)SC3CNNCC3N2
|
|
481
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
482
|
c1ccc2c(c1)c3c(c(=O)s2)nc[nH]3
|
|
483
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
484
|
c1ccc2c(c1)[C@@H]3c4c(cccc4O2)C(=O)O3
|
|
485
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
486
|
c1ccc2c(c1)[C@@H](OC2=O)Nn3cnnc3
|
|
487
|
c1cc2c(c3c1non3)nns2
|
|
488
|
Cn1c(=O)[nH]c(=O)c(n1)C#N
|
|
489
|
C1CCC(C(C1)NC2[NH+]C(C(N2O)[O-])N)F
|
|
490
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
491
|
CC1NC2C(NCNC2NN1)N
|
|
492
|
Cn1c2=NC(=O)C(=O)N=c2c(=O)n(c1=O)C
|
|
493
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
494
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
495
|
Cc1ccc2c(c1)C[C@@H]3[C@@H](N2)C(=CN(C3=O)C)CO
|
|
496
|
c1ccc(cc1)n2c(nc(n2)[O-])c3cccs3
|
|
497
|
c1cc2c(c3c1[nH]cn3)c(c(cn2)c4[n-]nnn4)O
|
|
498
|
CC1=C(Cc2c(c(=O)c2=O)C1)C
|
|
499
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
500
|
Cc1cc(nc(n1)N=C2NCCN2)C
|
|
501
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
502
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
503
|
Cc1c2cc(ccc2[nH]n1)F
|
|
504
|
c1nc(no1)c2c(non2)N
|
|
505
|
CC(=O)Nc1c(c2c(s1)CCC2)C#N
|
|
506
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
507
|
Cn1c(=O)c(nn(c1=O)c2ccc(cc2F)F)c3ccn[nH]3
|
|
508
|
c1ccc2c(c1)CCN2c3ccc(s3)C(=O)[O-]
|
|
509
|
c1cnccc1C2c3c(c(n[nH]c3=O)[O-])Nc4c2c(=O)[nH]nc4[O-]
|
|
510
|
c1cc2c(c(c1)n3cccn3)CCCN2
|
|
511
|
CC(=O)Nc1cc2c(oc1=O)CCC2=O
|
|
512
|
Cc1cc(cc(c1)NC(=O)c2c(nco2)C)C
|
|
513
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
514
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
515
|
CN1CCOc2c1cnn(c2=O)CCO
|
|
516
|
c1cc2c(=O)[nH]nc(n2c1)[O-]
|
|
517
|
C([C@@H](CO)O)N1C(=O)[NH+]C(S1)N
|
|
518
|
c1ccc(cc1)CNc2cnoc2
|
|
519
|
c1csc2c1c(n[nH]c2=O)N
|
|
520
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
521
|
c1ccc2c(c1)C(=O)Nc3ccccc3N2
|
|
522
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
523
|
c1ccc(cc1)C(=O)O[C@@H]2CC(=O)N2
|
|
524
|
CC(=O)C1=C(c2ccccc2S(=O)(=O)N1)[O-]
|
|
525
|
c1ccc(cc1)NC(=O)n2ccnc2
|
|
526
|
c1ccc2c(c1)-c3ccccc3N=CN2
|
|
527
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
528
|
Cn1cccc1CCn2ccnc2
|
|
529
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
530
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
531
|
CC(=O)NC1CCCN2C1NNN2
|
|
532
|
c1cc(=O)oc2c1cc3c(c2O)OCC3
|
|
533
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
534
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
535
|
c1cc2c(c(c1)S(=O)(=O)[O-])nn[nH]2
|
|
536
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
537
|
C1COC(=CO1)c2nnc(o2)N
|
|
538
|
CSc1nccc(n1)c2cnoc2
|
|
539
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
540
|
c1cc2c(=O)[nH]c3c(n2c1)ccs3
|
|
541
|
Cc1nnnn1[C@@H]2CC(=O)[C@H]3OC[C@@H]2O3
|
|
542
|
c12c(non1)N=C3C(=Nc4c(non4)N3)N2
|
|
543
|
Cc1c(c(n[nH]1)O)[C@@H](c2ccco2)C(C#N)C#N
|
|
544
|
[H]/N=c/n2c(c(s1)c3ccccc3)NCC2
|
|
545
|
C1CCC2C(C1)-C3C(CN[NH]3)CCO2
|
|
546
|
CCSc1ccc(nn1)N
|
|
547
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
548
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
549
|
CC(=O)Nc1c-2sscc2n(c1=O)C
|
|
550
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
551
|
CC1NC(NO1)C2CN3C(C2C(C)C)C(=O)NC[NH]3
|
|
552
|
Cc1c(n2c(ncn2)nn1)[O-]
|
|
553
|
COc1ccc2nnnn2n1
|
|
554
|
c1cc(nnc1n2cnnn2)Cl
|
|
555
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
556
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
557
|
c1ccc-2c(c1)CCc3c2cn[nH]3
|
|
558
|
c1cc(ccc1NC(=O)c2cc(=O)[nH+]c(s2)N)F
|
|
559
|
c1cnn2c1[C@@H](n3c(ccn3)[C@@H]2O)O
|
|
560
|
c1ccc2c(c1)c(=O)cc3n2CC(=O)O3
|
|
561
|
CC[C@@H](c1cnn(c1)C)NC(=O)c2c(ocn2)C
|
|
562
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
563
|
c1cn2c(c1CO)[C@@H](CC2)O
|
|
564
|
Cc1cc(n2c(n1)ncn2)n3ccnc3
|
|
565
|
c1(nnnn1O)c2nnnn2O
|
|
566
|
c1c(cnnc1[O-])C(F)(F)F
|
|
567
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
568
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
569
|
c1ccc2c(c1)c3c(c(=O)o2)C=Nc4ccccc4N3
|
|
570
|
c1ccc(cc1)S(=O)(=O)n2cc(c(nc2=O)[O-])F
|
|
571
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
572
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
573
|
Cc1nnnn1c2cc3c(s2)CCCC3
|
|
574
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
575
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
576
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
577
|
c12c(nnnc1snn2)O
|
|
578
|
CC1=C(CC(=O)N1)C(=O)OC
|
|
579
|
c1c2cc(oc2ncc1F)CO
|
|
580
|
COc1c2cc[nH]c2nc(n1)OC
|
|
581
|
|
|
582
|
Cc1nnc(o1)c2ccc(c(c2)N)O
|
|
583
|
CC1(c2c([nH]c(=O)s2)Sc3c1sc(n3)[O-])C
|
|
584
|
c1ccc2c(c1)-c3c(cc(s3)C(=O)[O-])CS2
|
|
585
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
586
|
|
|
587
|
c1ccc2c(c1)nc3n2C(=O)CC(=N3)[O-]
|
|
588
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
589
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
590
|
Cc1cc(=O)oc-2c1C(=O)c3c2cccc3
|
|
591
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
592
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
593
|
c1cnccc1c2nnc3n2CCC3
|
|
594
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
595
|
Cc1csc(n1)c2c(non2)N
|
|
596
|
C1NC(C2N1[C@@H]3[C@H]([C@@H]([C@@H](O3)CN2)O)O)C(=O)N
|
|
597
|
c1ccc2c(c1)c(c[nH]2)c3nn4cnnc4s3
|
|
598
|
c1ccc2c(c1)CCc3c(cc(cc3O2)N)N
|
|
599
|
c1ccc(cc1)c2nnnn2Cn3ccnc3
|
|
600
|
COCCN1C2C(C(NC(N2)N)N)N=C3C1=CCCC3
|
|
601
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
602
|
c1c2n(cn1)[C@@H](CCC2)CCCC#N
|
|
603
|
|
|
604
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
605
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
606
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
607
|
c1cnc2cc3c(cc2n1)[C@@H]4C[C@H]3C(=O)NC4
|
|
608
|
c1csc2c1NCCNC2=O
|
|
609
|
Cn1c(c(nnc1=O)c2ccsc2)c3ccsc3
|
|
610
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
611
|
c1ccc2c(c1)c3c(c(=O)o2)CNCO3
|
|
612
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
613
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
614
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
615
|
c1ccc(cc1)Nc2cn[nH]n2
|
|
616
|
c1c(cc(c2c1C=C(OC2)CO)O)O
|
|
617
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
618
|
C1CCC(CC1)[C@@H]2CC(=O)N3CNNC3S2
|
|
619
|
c1c([nH]nn1)SCC(=O)N
|
|
620
|
c1ccc(cc1)Cn2c(=O)ccc3c2n[nH]n3
|
|
621
|
c1cc(n[nH]c1=O)NC2CC2
|
|
622
|
Cc1nc(cs1)c2nnc(n2c3cccc(c3)F)SC
|
|
623
|
C1C=C[C@@H]([C@@H]2N1C(=O)OC2)O
|
|
624
|
Cc1ccc2c(c1)n3c([nH+]2)NCCC3
|
|
625
|
Cc1c-2c(on1)CCc3c2n(nc3C(=O)[O-])C
|
|
626
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
627
|
CCOC(=O)c1c(=O)c2c(n3c1[NH2+]CC3)CCC2
|
|
628
|
C1CCc2c(c3c(s2)C(=O)NCC3)C1
|
|
629
|
COC(=O)CCCC1CCC(=O)N2C1NCCC2
|
|
630
|
COc1cc(c(s1)C(=O)OC)OC(=O)c2ccco2
|
|
631
|
c1csc2c1CN(CC2)C(=O)N
|
|
632
|
c1c[nH]c2c1sc(c2)C(=O)[O-]
|
|
633
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
634
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
635
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
636
|
c1ccc(cc1)n2c(nnc2[O-])c3cccnc3
|
|
637
|
C1CCC2C(C1)C3CCNC4C3N2CCCC4=O
|
|
638
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
639
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
640
|
Cc1n[nH]c(=O)n1Nc2ccccc2
|
|
641
|
c1[nH]c(=O)c2c(n1)Oc3c(c(=O)[nH]cn3)C2
|
|
642
|
c1cc(ccc1C2=CCn3c(nnn3)N2)F
|
|
643
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
644
|
c1ccc2c(c1)C[C@H]([C@@H]2O)O
|
|
645
|
C[C@@]12CCC(=O)N1C3CNCNC3N2
|
|
646
|
c1ccc(cc1)n2c3c(cn2)c(ncn3)N
|
|
647
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
648
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
649
|
|
|
650
|
c1ccnc(c1)SC[C@H](COCc2ccco2)O
|
|
651
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
652
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
653
|
C1NC2N(N1)[C@@H]3C[C@](N2)([C@H]4OC[C@@H]3O4)O
|
|
654
|
CC1C(CN2C1C(=O)[NH]CN2)[O-]
|
|
655
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
656
|
c1cc2c(cc1I)C3=C(C2)C(=O)NCC3
|
|
657
|
c1ccc2c(c1)nc3n2CN=C4N3CN(CN4)CCO
|
|
658
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
659
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
660
|
CN1CCn2ccc3c2c1nc(=O)[nH]3
|
|
661
|
c1csc2c1ncnc2n3ccnc3
|
|
662
|
CN1[C@@H]2[C@@H](C(=NC1=O)[O-])N=C(N2)Cl
|
|
663
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
664
|
CSc1c-2c(cs1)CCc3c2n[nH]c3
|
|
665
|
Cc1c(=O)nc([nH]n1)c2cccs2
|
|
666
|
c1cc2c(cc1N)c3c(o2)CCC3
|
|
667
|
C1C[C@@H]2C(=O)NCC(=O)N2C1
|
|
668
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
669
|
c1ccc2c(c1)CC(=C2)n3ccnc3
|
|
670
|
COC(=O)CCc1c[nH]cn1
|
|
671
|
CSc1/c(=CN)/n2cnnc2n1
|
|
672
|
c1cc(oc1)c2cc(no2)CO
|
|
673
|
Cc1c(c[nH]n1)c2ccccc2
|
|
674
|
c1ccc2c(c1)c(=O)n3c(n2)ccc(=O)[nH]3
|
|
675
|
c1ccc(cc1)C[C@@H]2CCOC(=O)N2
|
|
676
|
c1cc(oc1)c2nnc(s2)N
|
|
677
|
c1ccc-2c(c1)CC(=O)Cc3c2cccc3
|
|
678
|
c1c(cnc2c1oc(=O)[nH]2)Br
|
|
679
|
CC1=C/C(=C/2C=CC=CC2=O)/N=C(N1)N
|
|
680
|
c1cc(oc1)[C@@H]2C[C@@H]2C(=O)[O-]
|
|
681
|
c1cc(sc1)c2cnnc(n2)[O-]
|
|
682
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
683
|
c1cc(sc1)c2c(non2)N
|
|
684
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
685
|
Cc1c(nnn1C)c2csnn2
|
|
686
|
CC1CCC(N1N2C(NNN2)N)C
|
|
687
|
c1cc2cccc3c2c(c1)C(=O)N3
|
|
688
|
c1coc2c1cc(cc2O)F
|
|
689
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
690
|
C(c1c(non1)N)c2c(non2)N
|
|
691
|
c1ccc(cc1)C(=O)C(O)O
|
|
692
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
693
|
C1=CC=CC(C=C1)NC(=O)N
|
|
694
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
695
|
CC1NNC(S1)C2C([NH]N(C2=O)C)NC(=O)C
|
|
696
|
CC1NNC2N1-C3CCCCC3-C4C(C5CCCCC5[NH]4)C2
|
|
697
|
CCN1CCc2c(c([nH]c(=O)c2C#N)[O-])C1
|
|
698
|
c1[nH]c2c(n1)C(=O)C[NH+]=CN2
|
|
699
|
c1cc2cncn2c(c1)CCCCCC#N
|
|
700
|
CC1NC(ON1)C2CNCCN2
|
|
701
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
702
|
c1ccc(cc1)c2nc(cs2)c3ccn[nH]3
|
|
703
|
C1C[C@@H]2N=Cc3c(c(sc3N2C1)C(=O)N)N
|
|
704
|
c1ccc2c(c1)c(c(s2)NC(=O)O)C#N
|
|
705
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
706
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
707
|
|
|
708
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
709
|
Cn1c2c(c(=O)[nH]c1=O)[C@H](CC(=O)N2)C(=O)[O-]
|
|
710
|
CCOC(=O)C1=C(Nn2cnnc2S1)C
|
|
711
|
CC1=Nc2c(cccn2)NC(=O)C1
|
|
712
|
CCn1cc(cn1)c2cc[nH]n2
|
|
713
|
Cc1ccc(cc1)c2cn[nH]n2
|
|
714
|
c1cc2cccc3c2c(c1)C4=NCCN=C34
|
|
715
|
Cc1cc(n(n1)c2nc(cc3n2ncn3)N)C
|
|
716
|
C1Cc2c(non2)-c3c1non3
|
|
717
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
718
|
c1ccc(cc1)C2=C(NNC(=[NH2+])N2)c3ccccc3
|
|
719
|
|
|
720
|
C1C(C(=O)[NH]C(=O)O1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
721
|
c1ccc-2c(c1)CSc3c2nc(nc3)N
|
|
722
|
C1C(=O)CC2NN[NH]N2C1N
|
|
723
|
|
|
724
|
C1CCC2C(C1)-C3C(CNCN3)S(=O)(=O)CO2
|
|
725
|
c1c2c(co1)[nH]c(=O)c(=O)[nH]2
|
|
726
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
727
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
728
|
c1ccc2c(c1)NS(=O)(=O)N2
|
|
729
|
COC(=O)c1cc2c(n1C(=O)OC)snn2
|
|
730
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
731
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
732
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
733
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
734
|
CC1=NCCNc2c1c(=O)n(c3c2cccc3)C
|
|
735
|
C1=C(C=C([C@H]2C1=NC=N2)N)C(=O)[O-]
|
|
736
|
c1ccc-2c(c1)CCc3c2n[nH]c3
|
|
737
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
738
|
c1ccc(cc1)/C=C/2NC(=O)C(=O)O2
|
|
739
|
CCC1CCC(CC1)CCC(=O)/N=C/2[NH]CC([NH]2)[O-]
|
|
740
|
COC(=O)c1c2c(n3cnnc3n1)OCC2
|
|
741
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
742
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
743
|
c1cc(cnc1)c2cc(c3c(n2)nc(nc3[O-])N)C(F)(F)F
|
|
744
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
745
|
C1CCC(CC1)S(=O)(=O)OC2CCC(NN2)[O-]
|
|
746
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
747
|
c1ccc(cc1)c2c3ccsc3nc4c2COCC4
|
|
748
|
Cc1cc(no1)c2c(c(no2)C)CO
|
|
749
|
c1cc2c(c(c1)F)CC(=O)N2
|
|
750
|
c1ccc(cc1)[C@H]2C(=O)NN=C2[O-]
|
|
751
|
Cc1nnn(n1)Cc2nnnn2C
|
|
752
|
|
|
753
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
754
|
CC1=N/C(=C/c3ccccc3C(=O)O2)/C(=O)O1
|
|
755
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
756
|
CCCc1nc2c(o1)cccn2
|
|
757
|
c1cc(oc1)c2cc[nH]c(=O)c2C#N
|
|
758
|
C1(=O)[NH]C(=O)N2N1[C@@H](NC2=O)O
|
|
759
|
c1ccnc(c1)n[nH]/c2=NC(=O)C3CC3
|
|
760
|
c1ccc2c(c1)ncc(n2)NCc3ccoc3
|
|
761
|
c1ccc(cc1)Nc2nc(ns2)N
|
|
762
|
Cc1c(c2c(n1c3ccccc3)c(ncn2)N)C#N
|
|
763
|
C=CCN1[C@@H]2C=CC=C[C@@H]2C(=O)C1=O
|
|
764
|
CCN1CNNC1C2C3CCCCC3SN2
|
|
765
|
CC1C2C(C(CN1)CO)C=C3CCCC=C3O2
|
|
766
|
CC(C)n1c(c(cn1)C#N)N
|
|
767
|
c1ccc2c(c1)-c3nncn3-c4ccccc4S2
|
|
768
|
c1nncn1/N=N/n2cnnc2
|
|
769
|
COc1c2c([nH]n1)nncn2
|
|
770
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
771
|
C1CN2C(=O)C3C(C(C(C(C3SC2=N1)F)F)F)F
|
|
772
|
c1c2c(nc(n1)N)CCCC2=O
|
|
773
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
774
|
C[C@@H]1C(=N[C@@]2([C@@]1(c3ccccc3-c4c2cccc4)O)O)C
|
|
775
|
c1c(n2c(n1)CCC2)C(=O)[O-]
|
|
776
|
c1ccc2c(c1)ncn2c3c(nns3)C(=O)N
|
|
777
|
Cc1c(=O)n2c(nn1)SCC(=O)N2
|
|
778
|
Cn1c2c(cccn2)nc(c1=O)[NH+]3CCC[C@@H]3C(=O)[O-]
|
|
779
|
c1nc([nH]n1)c2c(non2)N
|
|
780
|
CCc1c(cccn1)C(=O)[O-]
|
|
781
|
c1ccc(cc1)n2c3c(cn2)C(=O)CC3
|
|
782
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
783
|
c1c2c3c(c(=O)ncn3CC2)c(n1)Cl
|
|
784
|
C1CCN(C1)c2c(nns2)CO
|
|
785
|
COC(=O)/C=c/c(=O)n2c(s1)ncn2
|
|
786
|
c1cc(nc2c1Nc3c(c(ncn3)N)S2)Cl
|
|
787
|
c1ccnc(c1)Nc2nsc(=O)n2c3ccccn3
|
|
788
|
c1ccc2c(c1)C(=NS2(=O)=O)n3ccnc3
|
|
789
|
Cc1ccc(cc1)n2cnnn2
|
|
790
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
791
|
Cn1c(=O)n2cnc(c2nn1)C#N
|
|
792
|
[H]/N=c/n([nH+]c(s1)C)CC(=O)[O-]
|
|
793
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
794
|
Cc1ccccc1C(=O)C(C)(C)C
|
|
795
|
c1cc(sc1)c2c[nH]nc2
|
|
796
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
797
|
c1cnnc2c1c(c(s2)C(=O)N)N
|
|
798
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
799
|
c1c(cncn1)n2cc(nc2)N
|
|
800
|
c1c2c(=O)[nH]c(nc2n[nH]1)[O-]
|
|
801
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
802
|
c1ccc2c(c1)-n3cnnc3CCS2
|
|
803
|
CN1C=NC2C(NCN2[C@@H]3CC[C@@H](O3)CO)[C@@H]1O
|
|
804
|
Cc1c2cnc3ccccc3n2nn1
|
|
805
|
CC(=O)Nc1c2c(no1)CCC2
|
|
806
|
|
|
807
|
Cc1cc(=O)n2c(n1)nc(c(n2)C)[O-]
|
|
808
|
c1cc(=O)n2n(c1=O)CN(C2)n3cnnc3
|
|
809
|
c1ccc2c(c1)nc3=C(C(=c3n2)O)O
|
|
810
|
Cc1ccc(cc1)c2cnon2
|
|
811
|
C1CC1N2C[C@@H](CC2=O)CO
|
|
812
|
Cc1ccc(cc1)n2cnnc2
|
|
813
|
c1cc(sc1)c2ccncn2
|
|
814
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
815
|
Cc1nc(on1)c2c(non2)N
|
|
816
|
COC(=O)N1CNC2C1[NH]NCC2=O
|
|
817
|
Cc1c(non1)NS(=O)(=O)c2ccccc2
|
|
818
|
c1cc2c(nc1)nc(o2)N3CCCC3
|
|
819
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
820
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
821
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
822
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
823
|
c1ccc2c(c1)CCC(=C2)n3ccnc3
|
|
824
|
CN1CCCc2c1sc(c2)C(=O)[O-]
|
|
825
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
826
|
CC(=O)Nc1c(cn[nH]1)C#N
|
|
827
|
Cc1c2c(on1)COc3ccccc3C(=O)C2
|
|
828
|
COC(=O)Nc1cc(cc(=O)o1)O
|
|
829
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
830
|
c1c(=O)cc(n2c1CCC2)O
|
|
831
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
832
|
c1ccc2c(c1)c(c3c(n2)[C@@H]4OC[C@H](C3)O4)C(=O)[O-]
|
|
833
|
Cc1cc(nc(c1C(=O)N)c2cnn(c2)C)C
|
|
834
|
c1coc2c1[nH]c(c2)C(=O)[O-]
|
|
835
|
COc1cc2c(c3c(oc2=O)C(=O)CC3)c(c1OC)OC
|
|
836
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
837
|
CC(=CCC/C(=C/Cn1ccnc1)/C)C
|
|
838
|
CCN1CC(=C(C=C1O)C)C(=O)N
|
|
839
|
C1CN2C3C(C(=O)[NH]C2N1)SCCN3
|
|
840
|
Cc1cc(nc(n1)Nc2[nH]ncn2)C
|
|
841
|
|
|
842
|
Cc1ccc(nc1)n2cnnn2
|
|
843
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
844
|
CCc1c(nnc(c1C#N)[O-])CC
|
|
845
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
846
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
847
|
C/C=C/[C@@H]1OCC[C@@](O1)(C)C(=O)C2CCCCC2
|
|
848
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
849
|
c1ccc2c(c1)CC(=O)NC=C2
|
|
850
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
851
|
COC(=O)c1c(cc(=O)n2c1CCCCC2)[O-]
|
|
852
|
c1c(cnc2c1COC(=O)N2)Br
|
|
853
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
854
|
Cc1c2c(c3ccccc3[nH]2)c4c([o+]1)CCCC4=O
|
|
855
|
C[C@@H]1NC(=C2C(=N1)NC[NH]2)C(=O)N
|
|
856
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
857
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
858
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
859
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
860
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
861
|
c1c(cncc1Cl)OC(=O)C2=NC=NC2
|
|
862
|
c1cc2c(c(cs2)N)nc1
|
|
863
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
864
|
c1cnc(nc1C2=C3C(=NC2)CCNC3=O)N
|
|
865
|
Cc1c2c([nH]n1)C(=O)N([C@@H]2c3ccco3)C
|
|
866
|
c1ccc2c(c1)n3c(c(nn3)C(=O)N)sc4n2nnc4C(=O)[O-]
|
|
867
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
868
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
869
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
870
|
CC1C(C(OC(=O)[NH+]1)NC(C)C)CL
|
|
871
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
872
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
873
|
CC1CCC2C(C1)NNS2
|
|
874
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
875
|
CC1C2C(C3C(C1OC)CC(=O)O3)C(=O)OC2
|
|
876
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
877
|
c1ccc(cc1)Oc2c(non2)N
|
|
878
|
CNC(=O)Oc1ccccc1
|
|
879
|
c1cnoc1/C=C/c2c(cncc2Cl)Cl
|
|
880
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
881
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
882
|
c1ccc2c(c1)N3C[C@H](CN=C3S2)O
|
|
883
|
CC1C2C(NC(NN2)N3CCOCC3)N(N1)C4CCCCC4
|
|
884
|
CCSC1C2C(CN[NH]2)NCN1
|
|
885
|
Cc1cc(c2nncn2n1)n3cc(c(=O)[nH]c3=O)F
|
|
886
|
Cc1cc(=O)c(c(o1)Nc2nnns2)C(=O)C
|
|
887
|
C1CCc2c([nH]nc2O)CC1
|
|
888
|
c1cc2c(cc1S(=O)(=O)[O-])nc[nH]2
|
|
889
|
c1cnn2c1nnc(c2[O-])C#N
|
|
890
|
CC(=O)OCC1C(C-2C([NH]C1=O)CCC3C2CCCC3)[O-]
|
|
891
|
c1ccc2c(c1)nc(o2)Cn3cnc(n3)C#N
|
|
892
|
CCc1nnc(s1)NC(=O)c2c(ocn2)c3cccs3
|
|
893
|
c1nncn1N2C3=CCCCC3=C(C2=O)O
|
|
894
|
C1CCC2C(C1)N[C@@H](S2)C3CCC[NH]3
|
|
895
|
c1ccc2c(c1)CCN3[C@@H]2Cc4c(cno4)C3=O
|
|
896
|
c1ccc2c(c1)CNC(=O)CS2
|
|
897
|
c1ccc(cc1)c2cc(=O)c2=O
|
|
898
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
899
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
900
|
COc1ccc2c(c1)C[C@@H]2O
|
|
901
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
902
|
c1ccc2c(c1)[nH]c(n2)Nn3cnnc3
|
|
903
|
c1c[nH]c2c1ncc(n2)Cl
|
|
904
|
CCOC(=O)c1nn(c2n1c(=O)cc(n2)N)c3ccccc3
|
|
905
|
c1nc2nc(nc(n2n1)N)[O-]
|
|
906
|
c1nc(nn1CC(=O)N)C#N
|
|
907
|
Cc1nc2cc([nH]c2s1)C(=O)[O-]
|
|
908
|
c1nc2c3n1CCN=C3NC=N2
|
|
909
|
c1cc2c(cc1F)-c3c(cno3)CS2
|
|
910
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
911
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
912
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
913
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
914
|
c1c(nc(=O)n(n1)[C@@H]2CCCO2)N
|
|
915
|
COC(=O)c1c2cccc3c2c(o1)-c4ccccc4C3=O
|
|
916
|
c1cc(oc1)c2nnc3n2CCCCC3
|
|
917
|
c1ncn(n1)NCNn2cncn2
|
|
918
|
|
|
919
|
C1CCC(CC1)C2C3C(NO2)CCC3
|
|
920
|
c1cc2c(cc1N)c3c(c(=O)o2)NCCC3
|
|
921
|
CC/C(=C/1N=C(C(=O)O1)OC)/C2CCCCC2
|
|
922
|
C1CCC2C(C1)OC(=O)NS(=O)(=O)O2
|
|
923
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
924
|
c1ccc2c(c1)c3c(c(=O)o2)n[nH]n3
|
|
925
|
CC1C2C(C(C3N2N(N1)CC3)C(=O)OC)C(=O)OC
|
|
926
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
927
|
Cc1c(non1)N2CCOCC2
|
|
928
|
Cc1ccc(n1c2c(ccs2)c3cc([nH]n3)N)C
|
|
929
|
COC(=O)c1c(c2c([nH]1)c3ccccc3n4c2nnn4)N
|
|
930
|
CCc1nc2ccccc2c(=O)n1N
|
|
931
|
c1ccc2c(c1)n3c(s2)nnn3
|
|
932
|
c1ccc(cc1)c2cc(cc(=O)o2)[O-]
|
|
933
|
C(#N)c1c(c2c(nc1N)non2)N
|
|
934
|
c1ccc(cc1)CCn2cnnn2
|
|
935
|
COc1c(cc2c-3c1COc4c3c(cc(c4)O)CC2)O
|
|
936
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
937
|
c1c2cn[nH]c2cnc1Cl
|
|
938
|
c1cc2c(cc(=O)oc2cc1O)N
|
|
939
|
COc1c2c(ncn1)SCC(=O)N2
|
|
940
|
c1cc2c(nc1)[C@@H](O[C@@H]2O)O
|
|
941
|
c1csc(c1Cl)c2c[nH]c(c2C#N)N
|
|
942
|
CCOC(=O)Cn1nnnn1
|
|
943
|
c1csc2c1CCO[C@@H]2CC(=O)[O-]
|
|
944
|
|
|
945
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
946
|
c1ccc2c(c1)c(cs2)Cc3[n-]nnn3
|
|
947
|
C[C@@]1(CC1(Br)Br)C(=O)n2c(ncn2)N
|
|
948
|
c1cc2c(cc1F)C(=O)NC2
|
|
949
|
c1cc2c3c(c1)C(=O)CC3=CCCC2
|
|
950
|
c1ccc2c(c1)CCc3ccccc3N2
|
|
951
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
952
|
CC1CN(C2C1-C3C(CN[NH]3)CC2)C
|
|
953
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
954
|
CCOC(=O)c1c(n2cnnc2s1)C
|
|
955
|
C[C@@H]([C@H]1[C@@H](NC1=O)OC(=O)C)O
|
|
956
|
c1ccn2c(c1)nc3c2cc(s3)C(=O)[O-]
|
|
957
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
958
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
959
|
CN1CC2C(N1)CNN(C2=O)C
|
|
960
|
Cc1ccc(c(c1)n2cccn2)c3c4c(nc[nH]4)ncn3
|
|
961
|
Cc1nc2n(n1)C3=CC(CC(=O)C3=NN2)(C)C
|
|
962
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
963
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
964
|
c1ccc2c(c1)-c3c(sc(n3)N)CS2
|
|
965
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
966
|
C=CCNC1CCNC(N1)N
|
|
967
|
c1ccc2c(c1)oc(=O)c(=O)o2
|
|
968
|
C1CC2(CC2)[C@@H]3[C@@H]1NC(=O)C3
|
|
969
|
C1NC(C2N1CCC(=O)N2)C(=O)N
|
|
970
|
c1nc([nH]n1)/N=C(/NC(C(F)(F)F)C(F)(F)F)[O-]
|
|
971
|
c1cc(c2c(c1)non2)CO
|
|
972
|
c1ccnc(c1)SCc2ccco2
|
|
973
|
CSc1nc2ncnn2c(n1)[O-]
|
|
974
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
975
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
976
|
C1C(SC(N1)N)[C@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
977
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
978
|
c1cc(nc2c1NC(=O)C2)F
|
|
979
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
980
|
C=CCc1cc(ccc1O)O
|
|
981
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
982
|
CN1CC(N(C(=O)C1=O)C)CL
|
|
983
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
984
|
Cc1nc2c(s1)c(nnc2[O-])c3ccco3
|
|
985
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
986
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
987
|
c1nnc2n1nc3c(c2[O-])CCC3
|
|
988
|
c1ccc2c(c1)CCNC(=O)C(=O)N2
|
|
989
|
C(#N)c1c2c(nc3c1sc(=O)s3)sc(=O)s2
|
|
990
|
c1cnc2c(n1)C(=O)NCN2
|
|
991
|
c1ccc(cc1)CSc2[nH]ncn2
|
|
992
|
CSc1c(cc(c(=O)[nH]1)c2cccs2)C#N
|
|
993
|
Cc1c(non1)NCNc2c(non2)C
|
|
994
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
995
|
c1csc2c1NC(=O)CCC2
|
|
996
|
CC1CCC2C3C1C(=O)[C@@H](C3=CCN2C(=O)C)C(=O)N
|
|
997
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
998
|
c1ccc2c(c1)c3c(con3)c(=O)o2
|
|
999
|
c1cc2c(cc1Br)-n3c(noc3=O)CO2
|
|
1000
|
C1C[NH+]=C2N(C1)c3c(c(=O)[nH]c(=O)[nH]3)S2
|
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