Menu
Virtual screening for IDP 3G0S - surface: 3
(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
|
2
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
|
3
|
CC(=O)N[C@H]1c2nc(cn2[C@@H]([C@H]([C@@H]1O)O)CO)CC(=O)[O-]
|
|
|
4
|
c1cc(cc(c1)n2cccn2)c3[n-]nnn3
|
|
|
5
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
6
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
|
7
|
Cc1ccc(nc1)n2cnnn2
|
|
|
8
|
c1cc(nnc1n2cnnn2)Cl
|
|
|
9
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
|
10
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
|
11
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
|
12
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
|
13
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
|
14
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
|
15
|
CC1CCCC(N1)C2[N-]NNN2
|
|
|
16
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
|
17
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
|
18
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
|
19
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)[O-]
|
|
|
20
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
|
21
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
|
22
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
|
23
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
|
24
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
|
25
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
|
26
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
|
27
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
|
28
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
|
29
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
|
30
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
|
31
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
|
32
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
|
33
|
c1ccc2c(c1)c(nnn2)Nc3ccccc3Cl
|
|
|
34
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
|
35
|
CC(=O)c1csc(n1)c2ccno2
|
|
|
36
|
C(c1c(non1)N)c2c(non2)N
|
|
|
37
|
C1C2CC3CC1CC(C2)(C3)n4nc(c(n4)C(=O)[O-])C(=O)[O-]
|
|
|
38
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
|
39
|
c1ccc2c(c1)C[C@@H](CO2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
40
|
Cc1cc(c(nn1)[O-])c2nc(cs2)C
|
|
|
41
|
Cc1c(c(n[nH]1)C)Sc2[nH]ncn2
|
|
|
42
|
Cc1nc(no1)c2cccc(c2)S(=O)(=O)NCC(=O)[O-]
|
|
|
43
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
|
44
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
45
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
|
46
|
Cc1c(nnc(n1)c2c(non2)N)C
|
|
|
47
|
C1C(C(NCN1)N)CCC2OCCO2
|
|
|
48
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
49
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
50
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
|
51
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
|
52
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
53
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
|
54
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
|
55
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
|
56
|
|
|
|
57
|
Cn1c(ccn1)c2cc(on2)C(=O)[O-]
|
|
|
58
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
|
59
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
|
60
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
|
61
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
|
62
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
|
63
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
|
64
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
|
65
|
Cc1n[nH]c(=O)n1Cn2c(n[nH]c2=O)C
|
|
|
66
|
c1ccc2c(c1)nnn2c3nnns3
|
|
|
67
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
|
68
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
|
69
|
Cc1cc(on1)[C@@H]2CCCN2Cc3nnc(o3)C
|
|
|
70
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
|
71
|
c1ccc-2c(c1)CCc3c2nc4c(n3)c(ncn4)O
|
|
|
72
|
Cc1c2ccccc2nc(c1C(=O)[O-])Cn3cccn3
|
|
|
73
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
|
74
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
|
75
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
|
76
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
|
77
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
|
78
|
CCCNC(=O)Cc1nc[nH]n1
|
|
|
79
|
|
|
|
80
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
|
81
|
|
|
|
82
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
|
83
|
CN1[C@@H](c2c(cccn2)C1=O)CC(=O)[O-]
|
|
|
84
|
Cc1nc(sn1)c2ccc(nn2)OC
|
|
|
85
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
|
86
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
|
87
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
|
88
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
|
89
|
c1cc(c(nc1)n2cncn2)N
|
|
|
90
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
|
91
|
Cc1cc(nc(n1)C)n2c3ccccc3nn2
|
|
|
92
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
93
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
|
94
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
|
95
|
c1cc2c(c3c1[nH]cn3)c(c(cn2)c4[n-]nnn4)O
|
|
|
96
|
C/C(=CCc1cccc(n1)C(=O)N)/CCC(=O)[O-]
|
|
|
97
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
|
98
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
|
99
|
C1CCC(C1)C(=O)Nc2[n-]nnn2
|
|
|
100
|
Cc1cc(n(n1)CNc2c(non2)C)C
|
|
|
101
|
c1ccc(cc1)c2nc3[nH]ncn3n2
|
|
|
102
|
c1c(c(n[nH]1)n2cnnc2)C(=O)[O-]
|
|
|
103
|
Cc1cc(nc(n1)n2c3c(cn2)C(=O)CCC3)C
|
|
|
104
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
|
105
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
|
106
|
C1NC([NH]N1)NC2=NCCO2
|
|
|
107
|
Cn1ncc(n1)NC(=O)CCc2cn3ccccc3n2
|
|
|
108
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
|
109
|
C1CSC2N1CC(N2)CN3CNC(N3)C#N
|
|
|
110
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
|
111
|
CC(=O)c1ncc(o1)c2ccccn2
|
|
|
112
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
|
113
|
Cc1nc(on1)c2c(non2)N
|
|
|
114
|
c1cc(sc1)C(=O)NCCc2c[nH]c[nH+]2
|
|
|
115
|
CSc1nccc(n1)c2cnoc2
|
|
|
116
|
CNc1nnc(s1)c2cnccn2
|
|
|
117
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
|
118
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
|
119
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
|
120
|
c1cc(cnc1)C2=Nc3c(nc([nH]c3=O)N)C2
|
|
|
121
|
Cn1ccc(n1)C(=O)n2cccn2
|
|
|
122
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
|
123
|
COc1cc(=O)nc(o1)c2ccco2
|
|
|
124
|
CN(C/C(=N/c1[nH]ncn1)/[O-])c2ccccc2
|
|
|
125
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
|
126
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
|
127
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
|
128
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
|
129
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
|
130
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
|
131
|
Cc1cc(nc(c1C(=O)N)c2cnn(c2)C)C
|
|
|
132
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
|
133
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
|
134
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
|
135
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
|
136
|
Cc1c(nn(n1)c2ccccc2)C(=O)n3cccc3
|
|
|
137
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
|
138
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
|
139
|
|
|
|
140
|
CCOC(=O)c1cnc(nc1Sc2nnc(s2)C)SC
|
|
|
141
|
CC1=C(Sc2nc3ccccc3c(=O)n2N1)C(=O)[O-]
|
|
|
142
|
CSc1c2ccccc2nnn1
|
|
|
143
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
|
144
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
|
145
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
|
146
|
Cc1c(non1)OCCOc2c(non2)C
|
|
|
147
|
C1CCC2C(C1)C3C(O2)C(=O)C(CS3)C(=O)[O-]
|
|
|
148
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
|
149
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
|
150
|
C=CCOC1CCNC(N1)N
|
|
|
151
|
c1ccc2c(c1)[nH]c(n2)n3cnnc3
|
|
|
152
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
|
153
|
c1cc(ccc1[C@@H](c2c(nc3nnc(n3n2)N)[O-])C(=O)[O-])Cl
|
|
|
154
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
155
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
|
156
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
|
157
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
|
158
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
|
159
|
Cn1c(cc(n1)c2ccccc(=O)c2[O-])C(=O)[O-]
|
|
|
160
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
|
161
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
|
162
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
|
163
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
|
164
|
Cn1c(ncn1)COc2cccc(n2)Cl
|
|
|
165
|
c1c([nH]nc1C(=O)[O-])C2CC2
|
|
|
166
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
|
167
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
|
168
|
CN(C)c1nc(nc(n1)Oc2ccc(=O)[nH]n2)N
|
|
|
169
|
Cc1c(c(n(n1)Cc2[n-]nnn2)C)Br
|
|
|
170
|
CCn1ccnc1SCc2nc(nc(n2)N)N
|
|
|
171
|
Cc1c(oc(n1)SCC(=O)[O-])C
|
|
|
172
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
|
173
|
C1C(=O)CC2NN[NH]N2C1N
|
|
|
174
|
|
|
|
175
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
|
176
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
|
177
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
|
178
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
|
179
|
CCOC(=O)c1c([nH]n2c1nnc2C(F)F)C(F)(F)F
|
|
|
180
|
[H]/N=c/1onc(s1)c2c(non2)N
|
|
|
181
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
|
182
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
|
183
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
|
184
|
c1ccc(cc1)n2c(c(c(nc2=O)Cn3cncn3)C#N)N
|
|
|
185
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
|
186
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
|
187
|
c1cc(oc1C#CC(=O)[O-])Br
|
|
|
188
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
|
189
|
c1c(nc(cn1)Cl)n2cncn2
|
|
|
190
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
|
191
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
|
192
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
|
193
|
Cc1c(nnc(c1c2c(cc(cn2)C(F)(F)F)Cl)O)C
|
|
|
194
|
c1cc(cnc1)[C@@H]2Nc3c(nc[nH]3)C(=O)N2
|
|
|
195
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
|
196
|
c1ccc(cc1)COc2c(non2)N
|
|
|
197
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
|
198
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
|
199
|
|
|
|
200
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
|
201
|
Cc1nnc(o1)CSc2nccn2C
|
|
|
202
|
Cc1c2c(nc(n1)N)OCC2
|
|
|
203
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
|
204
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
|
205
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
|
206
|
c1ccc(cc1)n2cnc(nc2=[NH2+])N
|
|
|
207
|
Cc1cc(=O)c(c(o1)Nc2nnns2)C(=O)C
|
|
|
208
|
CC(=O)NC1CCC2C(C1)NCNN2
|
|
|
209
|
c1csc2c1-c3c(c(no3)C(=O)[O-])CC2
|
|
|
210
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
|
211
|
c1cc(oc1)C(=O)N[C@@H]2CC(=O)c3c2ccs3
|
|
|
212
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
|
213
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
|
214
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
|
215
|
c1c(=O)[nH]c2c(n1)CCCC2
|
|
|
216
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
|
217
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
|
218
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
|
219
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
|
220
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
|
221
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
|
222
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
|
223
|
Cc1nnc(o1)CN2CCCc3c2cccc3
|
|
|
224
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
|
225
|
|
|
|
226
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
|
227
|
C1Cc2c(nn(c2N)CCC#N)C1
|
|
|
228
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
|
229
|
Cc1cc(nc(n1)Sc2ccc(nn2)Cl)C
|
|
|
230
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
|
231
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
|
232
|
CC(C)(C#Cc1cncnc1)OC(=O)NC
|
|
|
233
|
c1cc2c(cc1n3cnnn3)nc[nH]2
|
|
|
234
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
|
235
|
Cc1ccsc1/C(=N/c2n[nH]nn2)/[O-]
|
|
|
236
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
|
237
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
|
238
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
|
239
|
Cc1cc(n[nH]1)[N-]S(=O)(=O)c2cccs2
|
|
|
240
|
c1ccnc(c1)SCCn2cccn2
|
|
|
241
|
Cc1nc2cc(ccc2s1)n3c(c[nH]c3=O)O
|
|
|
242
|
c1ccc(cc1)C(=O)Nc2nc(ns2)[O-]
|
|
|
243
|
Cn1c2c(cn1)c(cc(n2)c3ccco3)C(F)F
|
|
|
244
|
c1ccc2c(c1)N(CCS2)c3ccc(s3)C(=O)[O-]
|
|
|
245
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
|
246
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
|
247
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
|
248
|
c1cnc(nc1c2nccs2)N
|
|
|
249
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
|
250
|
|
|
|
251
|
CC(=O)N[C@@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
|
252
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
|
253
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
|
254
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
|
255
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
|
256
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
|
257
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
|
258
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
|
259
|
Cc1cc(nn1C)c2nnc(s2)NC
|
|
|
260
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
|
261
|
|
|
|
262
|
C(C#N)c1nc(nc(n1)N)N
|
|
|
263
|
|
|
|
264
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
|
265
|
c1c(cncn1)n2cc(nc2)N
|
|
|
266
|
[H]/N=C/1NC(=C2C(=Nc3ccc(nc3S2)OC)[N-]1)N
|
|
|
267
|
Cn1c2ccnc(c2nn1)NCc3ccco3
|
|
|
268
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
|
269
|
Cc1cc(n(n1)c2nc(c(nn2)C)[O-])C
|
|
|
270
|
Cc1c(c2nc(c3c(n2n1)OCC3)C(=O)[O-])c4ccccc4
|
|
|
271
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
|
272
|
c1ccc(cc1)C2=Nc3c(non3)NC=C2
|
|
|
273
|
c1nc([nH]n1)c2c(non2)N
|
|
|
274
|
c1(c(non1)N)c2nnc(o2)N
|
|
|
275
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
|
276
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
|
277
|
CSc1cc(nn1C(=O)Cc2ccccc2)c3ccc(cc3)F
|
|
|
278
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
|
279
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
|
280
|
c1ncn(n1)CCn2cncn2
|
|
|
281
|
Cc1nc(on1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
|
282
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
|
283
|
C1NC2C(C(N1)N)NC(=O)C2
|
|
|
284
|
Cc1c(c(noc1=O)C)c2ccc(c(c2)C(=O)[O-])Cl
|
|
|
285
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
|
286
|
c1cnc(cn1)c2nnc(o2)N
|
|
|
287
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
|
288
|
c1csc(n1)S(=O)(=O)Cc2nnnn2C3CC3
|
|
|
289
|
Cc1nnc(s1)SCSc2ccccn2
|
|
|
290
|
Cc1cc(nn2c1nnc2)n3ccnc3
|
|
|
291
|
c1c(c[nH]c1C(=O)[O-])S(=O)(=O)N
|
|
|
292
|
c1[nH]c(c(n1)C(=O)[O-])C(=O)[O-]
|
|
|
293
|
c1ccc(cc1)n2c3c(c(ncn3)[O-])nn2
|
|
|
294
|
CCOc1cc(no1)Oc2ccccc2
|
|
|
295
|
c1ccn2c(c1)nc3c2cc(s3)C(=O)[O-]
|
|
|
296
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
|
297
|
c1ccc(cc1)OC(=O)Nc2nccs2
|
|
|
298
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
|
299
|
CCSC1C2C(CN[NH]2)NCN1
|
|
|
300
|
c1c(nnn1CC(=O)[O-])CO
|
|
|
301
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
|
302
|
Cc1nc2c(o1)CCc3ccccc3[C@@H]2O
|
|
|
303
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
|
304
|
c1nc(nc2n1c3c(n2)CCC3)N
|
|
|
305
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
|
306
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
|
307
|
c1ccc(cc1)c2nc3c(o2)c(nc(n3)N)[O-]
|
|
|
308
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
|
309
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
|
310
|
c1cnc(nc1c2cnccn2)N
|
|
|
311
|
C[C@@](c1ccccn1)(c2cn(nn2)c3ccccc3)O
|
|
|
312
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
|
313
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
|
314
|
c1ccc2c(c1)N3CCCN2c4c3cc(nn4)Cl
|
|
|
315
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
|
316
|
Cc1cc(c(nn1)[O-])c2nc3ccccc3n2C
|
|
|
317
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
|
318
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
|
319
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
|
320
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
|
321
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
|
322
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
|
323
|
Cc1nc(cs1)c2nnc(o2)N
|
|
|
324
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
|
325
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
|
326
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
|
327
|
c1cc(sc1)Cc2nc(c(o2)N)C#N
|
|
|
328
|
Cc1csc(n1)c2c(non2)N
|
|
|
329
|
c1csc2c1ncnc2n3ccnc3
|
|
|
330
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
|
331
|
CO/C(=N/c1nncs1)/[O-]
|
|
|
332
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
|
333
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
|
334
|
Cc1nc(cs1)c2cc(no2)CO
|
|
|
335
|
c1nc([nH]n1)OC23CC4CC(C2)CC(C4)C3
|
|
|
336
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
|
337
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
|
338
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
|
339
|
CN1CNNC1CNS(=O)(=O)N2CCCCC2
|
|
|
340
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
|
341
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
|
342
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
|
343
|
Cc1cc(nc(n1)SC)n2ccc(=O)[nH]c2=O
|
|
|
344
|
c1ccc-2c(c1)CCCc3c2[nH]c(n3)c4ccccn4
|
|
|
345
|
c1cc2c(nc1)NC3(N2)CCCCC3
|
|
|
346
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
|
347
|
c1c2c(cc3c1OCO3)nnn(c2=O)CCC4=CCC(=O)CC4
|
|
|
348
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
349
|
c1nc(c2c(n1)[nH]c(n2)[O-])N
|
|
|
350
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
|
351
|
CCO/C(=C/C1=NC(=O)[C@@](C1)(C(F)(F)F)[O-])/[O-]
|
|
|
352
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
|
353
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
|
354
|
CCOC=C(c1nnco1)c2nnco2
|
|
|
355
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
|
356
|
CC(C)Oc1cc(on1)c2[n-]nnn2
|
|
|
357
|
c1ccc(cc1)S(=O)(=O)[N-]c2cccnc2
|
|
|
358
|
CC1([C@@H]2CC[C@]1(c3c2nc(c(n3)C#N)C#N)C(=O)[O-])C
|
|
|
359
|
c1ccc(cc1)OCc2nnco2
|
|
|
360
|
c1ccc(cc1)Cn2cnnn2
|
|
|
361
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
|
362
|
Cc1cc(nc(n1)c2ccn[nH]2)Cl
|
|
|
363
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
|
364
|
Cc1cc(no1)c2nc(on2)C(C)(C)C
|
|
|
365
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
|
366
|
CC(=O)Nn1c2ccccc2nn1
|
|
|
367
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
|
368
|
c1cc(cnc1)CCc2c[nH+]c[nH]2
|
|
|
369
|
Cc1csc(n1)c2nnc(o2)N
|
|
|
370
|
Cc1cc(c(s1)C)C(=O)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
371
|
Cc1cc(no1)c2nnc(n2C)SC
|
|
|
372
|
c1cnnc(n1)c2nccnn2
|
|
|
373
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
|
374
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
|
375
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
|
376
|
c1ccn(c1)c2[n-]c(nn2)C(=O)[O-]
|
|
|
377
|
c1ccc2c(c1)nnn2c3ccc4nnnn4n3
|
|
|
378
|
Cn1cc(cn1)NCc2ccc[nH]2
|
|
|
379
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
|
380
|
c1cc(ncc1C#N)Sc2nccs2
|
|
|
381
|
C1CNC-2NCN3C(C12)NN[NH]3
|
|
|
382
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
|
383
|
Cc1c(cc(o1)C(=O)[O-])Sc2ccccc2C(=O)[O-]
|
|
|
384
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
|
385
|
CCOC(=O)CSc1cn2c(n1)CCC2
|
|
|
386
|
c1cc2c(cc1Cl)N=C3C(=NNC(=N3)[O-])S2
|
|
|
387
|
c1ccc(cc1)c2cncnc2
|
|
|
388
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
|
389
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
390
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
391
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
|
392
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
|
393
|
Cc1nnc(s1)Sc2cc(=O)oc3c2cccc3
|
|
|
394
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
|
395
|
c1cc(sc1)c2cncnc2
|
|
|
396
|
c1ccc2c(c1)nn(n2)Cc3ccco3
|
|
|
397
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
|
398
|
Cc1cc(n(n1)c2ncccn2)C
|
|
|
399
|
Cc1nc(on1)C(=O)NCc2ccco2
|
|
|
400
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
|
401
|
CC1CCC(CC1)S(=O)(=O)C2CN[NH]N2
|
|
|
402
|
C1CC(=C(N[C@@H]1C(F)(F)F)[O-])C(=O)[O-]
|
|
|
403
|
c1ccnc(c1)C(=O)c2ccc[nH]2
|
|
|
404
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
|
405
|
Cc1ccc(cn1)Oc2nc3ccccc3o2
|
|
|
406
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
|
407
|
c1cc(cnc1)C2=C(N3[C@@H](C2)CC3=O)C(=O)[O-]
|
|
|
408
|
Cc1c(nc([nH]1)C=C)C(=O)C
|
|
|
409
|
Cc1cc(no1)Cn2nc(nn2)c3ccccc3
|
|
|
410
|
c1cc2c(nc1)onc2Cl
|
|
|
411
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2ccnc2
|
|
|
412
|
CC(C)S(=O)(=O)c1c(c(=O)[nH]s1)c2ccccc2
|
|
|
413
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
|
414
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
|
415
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
|
416
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
|
417
|
CN(Cc1nnc(s1)SC)c2ccccc2F
|
|
|
418
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
|
419
|
CCS(=O)(=O)N1CCC[C@@H](C1)C(=O)Oc2cccnc2
|
|
|
420
|
CC(=O)NCCc1c[nH+]c[nH]1
|
|
|
421
|
CC(C)(C#CC(=O)[O-])C#CC(=O)[O-]
|
|
|
422
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
|
423
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
|
424
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
|
425
|
|
|
|
426
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
427
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
|
428
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
|
429
|
C1CCC2C(C1)C(=O)N3C(S2)NC(N3)N
|
|
|
430
|
CC(=O)N[C@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
|
431
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
|
432
|
Cc1cc(no1)CSc2ccccn2
|
|
|
433
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
434
|
c1cc(oc1)CN2C3=NC(=O)[C@@](C3=C(NC2=O)[O-])(C(F)(F)F)O
|
|
|
435
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
|
436
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
|
437
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
|
438
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
439
|
COc1ccc(nn1)[C@@H](C#N)c2nc3ccccc3s2
|
|
|
440
|
c1c([nH]nn1)SCC(=O)N
|
|
|
441
|
CC1CC2CC3CCCNN3C2NN1
|
|
|
442
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
|
443
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
|
444
|
CNC(=O)Nc1c2ccccc2nnn1
|
|
|
445
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
|
446
|
Cc1ccc(cc1)c2cnon2
|
|
|
447
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
|
448
|
c1ccc(cc1)c2cn(nn2)CC(=O)[O-]
|
|
|
449
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
450
|
C1CCN(CC1)c2[n-]nnn2
|
|
|
451
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
|
452
|
Cc1c(non1)NC(=O)OCCN2CCOC2=O
|
|
|
453
|
CCSc1nncn1Cc2ccco2
|
|
|
454
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
|
455
|
C1CCC2C(C1)OC[C@@H](O2)C(=O)C3NCCCN3
|
|
|
456
|
c1cc(c(nc1)n2cccn2)N
|
|
|
457
|
Cc1ccccc1CC(=O)N2CCCS2(=O)=O
|
|
|
458
|
|
|
|
459
|
c1cnn(c1)c2cncc(n2)Cl
|
|
|
460
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
|
461
|
c1cc(sc1)CC(=O)Nn2cnnc2
|
|
|
462
|
Cc1c2cc3c(nc2on1)C(=O)OCC3
|
|
|
463
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
|
464
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
|
465
|
|
|
|
466
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
467
|
C1C[C@@H](OC1)c2nc([nH]n2)N
|
|
|
468
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
|
469
|
c1csc2c1n3c(c(cn3)C(=O)[O-])nc2Cl
|
|
|
470
|
c1cc(sc1)C(=O)c2ccc(nn2)Cl
|
|
|
471
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
|
472
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
|
473
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
|
474
|
C1CC(C1)C(=O)N([C@H]2CC(=NC2=O)[O-])C3CC3
|
|
|
475
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
|
476
|
c1cncc(c1Sc2nnns2)S(=O)(=O)N
|
|
|
477
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
|
478
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
|
479
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
|
480
|
c1ccc2c(c1)[C@@H](CC(=O)N2)C(=O)N3CCn4c(ncn4)C3
|
|
|
481
|
CC1NC(ON1)C2CNCCN2
|
|
|
482
|
|
|
|
483
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
|
484
|
c1ccc2c(c1)c(=O)c(=Nc3[n-]nnn3)c2=O
|
|
|
485
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
|
486
|
Cc1c(non1)CNS(=O)(=O)CC=C
|
|
|
487
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
|
488
|
c1cc2c(c(c1)OCc3ccon3)CCCC2
|
|
|
489
|
c1ccc2c(c1)C[C@@H](O2)c3nnc(o3)N
|
|
|
490
|
Cc1c-2c(oc1C(=O)[O-])CCc3c2[nH]nc3
|
|
|
491
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
|
492
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
493
|
C1CCC2C(C1)-C3CNCNC3N=C(N2)N4CCCCC4
|
|
|
494
|
C[C@@H](C(=O)C1=N[C@@H]2C(=[NH+]C1)NC(=NC2=O)[NH-])[O-]
|
|
|
495
|
c1cc(sc1)C(=O)c2cnc3n2cccn3
|
|
|
496
|
c1(nnnn1O)c2nnnn2O
|
|
|
497
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
|
498
|
c1cn2c(=O)c3cncnc3sc2n1
|
|
|
499
|
c1ccc2c(c1)nnn2C3=NCCCC3
|
|
|
500
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
|
501
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
|
502
|
CCN1C(NN2C(C1=O)NC3CCCCC3C2=O)C
|
|
|
503
|
c1ccc2c(c1)nnn2CNn3cnnc3
|
|
|
504
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
|
505
|
c1cccc(c1)CC/C2=CC(=O)[O-]
|
|
|
506
|
C1CCC2C(C1)CC=N[C@@H]2CC(=O)[O-]
|
|
|
507
|
Cc1c2c(nc(oc2=O)c3ccccc3Cl)on1
|
|
|
508
|
CN1CC=NC2C1NC([NH]C2=O)N
|
|
|
509
|
|
|
|
510
|
Cc1nc(no1)CSc2nncs2
|
|
|
511
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
|
512
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
|
513
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
|
514
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
|
515
|
c1ccc(cc1)Sc2ccc(nn2)[O-]
|
|
|
516
|
CC(=O)Nc1ccc(o1)C(=O)[O-]
|
|
|
517
|
c1ccc2c(c1)[nH]c(n2)c3c(non3)N
|
|
|
518
|
CC1C(C(ON1)C)CC2NNC(O2)N
|
|
|
519
|
c1cc(cnc1)NCc2csnn2
|
|
|
520
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
|
521
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
|
522
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
|
523
|
Cc1c(cc(o1)c2ccno2)S(=O)(=O)NC
|
|
|
524
|
CC(=O)c1ccc(c(c1)F)Sc2nncs2
|
|
|
525
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
|
526
|
c1ccc(cc1)Nc2[nH]ncn2
|
|
|
527
|
c1cc(cnc1)C2=NC(=O)[C@@H](C=C2)C#N
|
|
|
528
|
Cc1cc(nn2c1nnc2)n3c(nc(n3)N)N
|
|
|
529
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
|
530
|
COc1ccc(cc1OC)[C@@H]2CC[C@@H](O2)Cc3cccnc3
|
|
|
531
|
Cc1ccc(nc1C)c2ccoc2
|
|
|
532
|
c1cc(oc1C(=O)[O-])S(=O)(=O)[O-]
|
|
|
533
|
c1ccc(cc1)c2nc(cs2)c3ccn[nH]3
|
|
|
534
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
|
535
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
|
536
|
CSc1nc2ncnn2c(n1)[O-]
|
|
|
537
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
|
538
|
c1ccc(cc1)c2c3ccccc3nnn2
|
|
|
539
|
C1C2C(NCN1)SC=C(N2)O
|
|
|
540
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
|
541
|
c1cc2c(nc1C#N)CCCN2
|
|
|
542
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
|
543
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
|
544
|
CCOC(=O)CNC1=c2ccccc2=[S@@](=O)(N=N1)O
|
|
|
545
|
c1cc(cnc1)C(=O)c2ccco2
|
|
|
546
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
|
547
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
|
548
|
c1ccc(cc1)Oc2c(non2)N
|
|
|
549
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
|
550
|
Cc1c(nnc2c1c(n[nH]2)N)C
|
|
|
551
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
|
552
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
|
553
|
c1csc2c1C(=O)N(CCC2)CC(=O)[O-]
|
|
|
554
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
|
555
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
|
556
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
|
557
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
|
558
|
CN1CCN=C(C=C1c2ccccc2O)C(=O)[O-]
|
|
|
559
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
560
|
CC1CC(NC(N1)N)SC2NCCS2
|
|
|
561
|
CSc1nnc(s1)CN2CCSc3c2cccc3
|
|
|
562
|
Cc1c(non1)COc2ccc(cc2)C(=O)[O-]
|
|
|
563
|
CN(C)c1nnnn1c2ncccn2
|
|
|
564
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
|
565
|
CCOC(=O)c1cnc(nc1Cn2cccn2)NC
|
|
|
566
|
Cc1c2c(ncnc2on1)N
|
|
|
567
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|