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Virtual screening for IDP 3O2R - surface: 2
(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
|
2
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
|
3
|
c1c[nH]n2c1nc(c2)C(=O)[O-]
|
|
|
4
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
|
5
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
|
6
|
c1(c(non1)N)c2nnc(o2)N
|
|
|
7
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
|
8
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
|
9
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
|
10
|
C1C2C(C(NC(N2)N)N)[NH]N1
|
|
|
11
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
|
12
|
Cc1c(c2c(s1)c(=O)[nH]nn2)C(=O)[O-]
|
|
|
13
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
|
14
|
Cc1cc(n(n1)CN2CCN(CC2)Cc3ccccc3)C
|
|
|
15
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
|
16
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
|
17
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
18
|
CC1NC(CS1)CN(C)CN2CNC(N2)C(=O)OC
|
|
|
19
|
c1ccc(cc1)NC(=O)/C=c/c(nc3n2ncn3)O
|
|
|
20
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
|
21
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
|
22
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
|
23
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
|
24
|
Cc1cc(no1)c2nnc(o2)N
|
|
|
25
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
|
26
|
c1nc(no1)c2c(non2)N
|
|
|
27
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
|
28
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
|
29
|
Cc1cc2n(n1)[C@@H](CC(=N2)O)C(=O)Nc3ccccc3F
|
|
|
30
|
c1cnc(nc1c2nccs2)N
|
|
|
31
|
CSc1nc(c(n1Cc2ccco2)C#N)N
|
|
|
32
|
c1cc2c(cc1Nc3nnc(o3)c4ccn[nH]4)OCO2
|
|
|
33
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
|
34
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
|
35
|
c1ccc2c(c1)c(=O)[nH]n(c2=O)C(=O)c3c(non3)N
|
|
|
36
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
|
37
|
c1nc([nH]n1)c2c(non2)N
|
|
|
38
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
|
39
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
|
40
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
|
41
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
|
42
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
|
43
|
|
|
|
44
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
45
|
c1ccc2c(c1)nc3n2C4(CCCC4)NC(=[NH+]3)N
|
|
|
46
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
|
47
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
|
48
|
CC1CCC2C(N1)C(=O)NC[NH]2
|
|
|
49
|
c1ccc(cc1)c2nnc(o2)Cn3cncn3
|
|
|
50
|
Cc1cc2c(o1)cc(nc2Nc3cccc(c3)Cl)C(=O)OC
|
|
|
51
|
C1C2C(NC(=O)[NH]1)OCCN2
|
|
|
52
|
c1cc2c(nc1)n(c(=O)o2)CCN3CCOCC3
|
|
|
53
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
|
54
|
C1CC(OC1)N2C(=O)C(C[NH]C2=O)F
|
|
|
55
|
c1nc-2[nH]c(c(nc2n1)N)[O-]
|
|
|
56
|
C=CCc1cccc(c1O)CN2CCn3c(nnc3CO)C2
|
|
|
57
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
|
58
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
|
59
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
|
60
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
|
61
|
c1ccc(cc1)Cc2cnc(nc2N)N
|
|
|
62
|
CSc1nc([nH]n1)/N=C([O-])/Oc2ccccc2
|
|
|
63
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
|
64
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
|
65
|
c1c(c([nH]n1)N)C2=CCCCC2
|
|
|
66
|
c1cnn(c1)c2cncc(n2)Cl
|
|
|
67
|
COc1ccnc(n1)Sc2[nH]cc(n2)c3ccccc3
|
|
|
68
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
|
69
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
|
70
|
CNC(=O)c1c2c(ccs2)nc(n1)NCc3cccnc3
|
|
|
71
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
|
72
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
|
73
|
c1cc(c(nc1)n2cncn2)N
|
|
|
74
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
|
75
|
c1c[nH]c2c1c(=O)c(c[nH]2)F
|
|
|
76
|
COC(=O)C1=CNN2C1=NCN(C2)Cc3ccccc3
|
|
|
77
|
c1cc(oc1)c2ccnc(n2)N
|
|
|
78
|
c1cc2c(c(n[nH]c2=O)[O-])nc1
|
|
|
79
|
c1c[nH]c(=O)c2c1oc(=O)c(c2)N
|
|
|
80
|
Cc1c(c(n(n1)C)Oc2cccnc2)N
|
|
|
81
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
82
|
c1ccc2c(c1)nc(c(=O)o2)N
|
|
|
83
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
|
84
|
Cc1cc2nc(nc(n2n1)N)N
|
|
|
85
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
|
86
|
c1(c(n[nH]n1)Cl)c2nc([n-]n2)Cl
|
|
|
87
|
c1(c(n[nH]n1)Cl)c2[n-]nnn2
|
|
|
88
|
Cn1cc(nc(c1=O)Nc2ccccc2)Br
|
|
|
89
|
CO[C@@H]1C=C[C@@H]2[C@@H](O1)CO[C@@H](O2)c3ccccc3
|
|
|
90
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
|
91
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
|
92
|
Cc1nc(c2n1nc[nH]c2=O)CC(C)C
|
|
|
93
|
c1c[nH]c2c1nc(=O)[nH]c2[O-]
|
|
|
94
|
CC(=O)c1n[nH]c2n1ncc2
|
|
|
95
|
|
|
|
96
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
|
97
|
Cn1ccc(n1)C(=O)OCC(=O)c2ccco2
|
|
|
98
|
C1CCc2c(nc(nn2)N)C1
|
|
|
99
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
|
100
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
|
101
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
|
102
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
|
103
|
c1[nH]c(=O)c2c(n1)NCCC2
|
|
|
104
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
|
105
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
|
106
|
C=CCOC1CCNC(N1)N
|
|
|
107
|
C1CC2C(NC1)CC[C@@H](O2)O
|
|
|
108
|
COc1ccc2c(n1)cc([nH]2)C=C
|
|
|
109
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
|
110
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
|
111
|
c1ccc(cc1)CNc2ncco2
|
|
|
112
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
|
113
|
CN(C)C1CCC(CC1)/C=C/C2C3C(NCCN3)NC(N2)N
|
|
|
114
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
|
115
|
Cc1nc(on1)c2c(non2)N
|
|
|
116
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
|
117
|
CS(=O)(=O)NCc1ccccn1
|
|
|
118
|
Cc1c2c(c(nnn2)[O-])n[nH]1
|
|
|
119
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
|
120
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
|
121
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
|
122
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
|
123
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
|
124
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
|
125
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
|
126
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
|
127
|
c1con2c1nc(c2)C(=O)[O-]
|
|
|
128
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
129
|
Cc1c(sc(c1C#N)Nc2c(nc3ccccc3n2)Cl)C
|
|
|
130
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
|
131
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3ccc(o3)Cl
|
|
|
132
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
|
133
|
c1c(=O)nc2n(n1)c(cs2)N
|
|
|
134
|
C[C@@H](c1cc[nH]n1)n2cncn2
|
|
|
135
|
c1cc(ccc1SCc2ccsc2c3ncns3)Cl
|
|
|
136
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
|
137
|
CCOc1c(c([nH]n1)N)C#N
|
|
|
138
|
c1ccc2c(c1)N[C@@H]3C[C@H](N2)O[C@@H]3[C@H](CO)O
|
|
|
139
|
Cn1c2c([nH]c1=O)nncn2
|
|
|
140
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
|
141
|
Cc1csc(n1)c2cn[nH]c2N
|
|
|
142
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
|
143
|
c1cc(oc1)c2nccs2
|
|
|
144
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
|
145
|
c1cc(ccc1/N=C(/Nc2[n-]nnn2)O)Cl
|
|
|
146
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
|
147
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
|
148
|
c1cnc(cn1)c2nnc(o2)N
|
|
|
149
|
c1cc([nH]c1)c2[nH]c(=O)on2
|
|
|
150
|
Cc1cc(n(n1)c2c(nc[nH]2)C(=O)NC)C
|
|
|
151
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
|
152
|
C([C@H](c1c(c(c(o1)O)[O-])O)O)O
|
|
|
153
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
154
|
COc1c2c([nH]n1)nncn2
|
|
|
155
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
|
156
|
Cc1c2ccccc2nc(n1)NC3=N[C@@H](C=C(N3)COC)O
|
|
|
157
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
158
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
|
159
|
C1NC2C(S1)C(=O)[NH]C(N2)N
|
|
|
160
|
c1cc(oc1)c2nc(c(o2)N)C#N
|
|
|
161
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
|
162
|
c1cc(ccc1NC(=O)Cc2ncon2)F
|
|
|
163
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
|
164
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
|
165
|
c1c2c(c(nc1N)O)n[nH]n2
|
|
|
166
|
CC1CC2CC3CCCNN3C2NN1
|
|
|
167
|
Cc1c(non1)OCCOc2c(non2)C
|
|
|
168
|
c1nc(c2c(n1)scn2)N
|
|
|
169
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
|
170
|
c1ccc(cc1)Nc2ccccn2
|
|
|
171
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
|
172
|
CNc1c2c(nc(n1)N)non2
|
|
|
173
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
|
174
|
c1ccc(cc1)CNc2cnccn2
|
|
|
175
|
Cc1cc(n2c(n1)ncn2)[O-]
|
|
|
176
|
CSc1nnc(s1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
177
|
c1ccc(cc1)CNc2c(non2)O
|
|
|
178
|
C[C@@H](n1cncn1)Oc2cccc(c2)Cl
|
|
|
179
|
CN(C)C(=O)Nc1[n-]nnn1
|
|
|
180
|
Cc1ccc(o1)C(=O)Cc2c(=O)oc3ccccc3n2
|
|
|
181
|
CCNc1nn2c(=O)cc(nc2s1)C
|
|
|
182
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
|
183
|
CCn1c(c(nn1)C(=O)N)N
|
|
|
184
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
|
185
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
|
186
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
|
187
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
|
188
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
|
189
|
Cc1ccc(nc1)n2cnnn2
|
|
|
190
|
c1ccc(cc1)NC(=O)OCc2cncs2
|
|
|
191
|
c1ccc(cc1)NC(=O)N[C@@H]2[C@@H](N=NS2)C(=O)[O-]
|
|
|
192
|
Cc1nnc(o1)CCNS(=O)(=O)C
|
|
|
193
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
|
194
|
C1CCC2C(C1)CO[C@@H](N2)C3CCC[NH]3
|
|
|
195
|
|
|
|
196
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
|
197
|
Cn1cnc2c1ncc(c2)C#N
|
|
|
198
|
Cn1c2c(c(=O)[nH]c1=O)non2
|
|
|
199
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
|
200
|
Cc1csc(n1)Cc2nc(no2)c3ccc(cc3)O
|
|
|
201
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
|
202
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
|
203
|
c1ccc2c(c1)N=C([C@@H](O2)CC(=O)[O-])O
|
|
|
204
|
C1c2c([nH]c(=O)[nH]c2=O)C(=O)O1
|
|
|
205
|
[H]/N=c/n(nc(s1)N2CCOCC2)Cc3ccccc3
|
|
|
206
|
c1cc2c(c(c1)S(=O)(=O)N)non2
|
|
|
207
|
c1c2n(nc1C(=O)[O-])CCOC2
|
|
|
208
|
Cn1c(ccn1)c2nnc(o2)N
|
|
|
209
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
|
210
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
|
211
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
|
212
|
CCCc1nncn1NC(=O)OCC
|
|
|
213
|
CN1CNNC1CNC2CNC3CCCCC3N2
|
|
|
214
|
c1cc(sc1)CCNc2ncccn2
|
|
|
215
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
|
216
|
CNC(=O)OCC#CCOC(=O)NC
|
|
|
217
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
|
218
|
Cn1cc(nc1)S(=O)(=O)N
|
|
|
219
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
|
220
|
|
|
|
221
|
c1cc(=O)oc2c1c3cc[nH]c3cc2
|
|
|
222
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
|
223
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
|
224
|
CN(CCO)c1cnccn1
|
|
|
225
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
|
226
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
|
227
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
|
228
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
|
229
|
C(#N)c1c(c2c(nc1N)non2)N
|
|
|
230
|
c1ncn(n1)NCNn2cncn2
|
|
|
231
|
c1cc(oc1)c2nc([nH]n2)N
|
|
|
232
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
|
233
|
C[C@@H](c1cc2ccoc2cn1)Sc3nc(cc(n3)Cl)N
|
|
|
234
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
|
235
|
c1cc(nnc1n2cnnn2)Cl
|
|
|
236
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
|
237
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
|
238
|
c1ccnc(c1)SCCn2cccn2
|
|
|
239
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
|
240
|
C[C@@H]1NC(=O)c2ccccc2O1
|
|
|
241
|
c1ccc(cc1)Nn2cncn2
|
|
|
242
|
Cc1cc(nc(n1)Nc2nc(on2)COc3ccccc3)C
|
|
|
243
|
C[C@@H]1[C@@H]2CNC(=[NH+][C@@H]2NC(=O)N1)O
|
|
|
244
|
Cc1c(nn2c(=O)c(nnc2n1)C)[O-]
|
|
|
245
|
c1cc([nH]c1)c2[nH][nH]c(=O)n2
|
|
|
246
|
CC1C2C(C([NH]1)C3CCCCC3)NC(OC2=O)C
|
|
|
247
|
C(C#N)c1nc(nc(n1)N)N
|
|
|
248
|
c1cnnc(n1)c2nccnn2
|
|
|
249
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
|
250
|
Cc1[nH]c(=O)c2c(n1)[nH]cn2
|
|
|
251
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
|
252
|
Cc1[nH+]ccn1CCc2nc(nc(n2)N)N
|
|
|
253
|
Cc1cc(n(n1)Cc2nnc(o2)SC)C
|
|
|
254
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
|
255
|
CSc1nc(c(s1)C#N)N
|
|
|
256
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
|
257
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
|
258
|
c1c2c(n3c(n1)ncn3)CCC2
|
|
|
259
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
|
260
|
c1cnoc1c2nnc(o2)N
|
|
|
261
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
|
262
|
C[C@H](CCc1ccco1)Nc2ncccn2
|
|
|
263
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
|
264
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
|
265
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
|
266
|
CC(=O)NCC1CNCCN1
|
|
|
267
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
|
268
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
|
269
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
|
270
|
c1c2cc(oc2ncc1F)CO
|
|
|
271
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
|
272
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
|
273
|
C[C@@H](c1ccco1)/N=c/2ccccn2C(=O)Nc3ccccc3
|
|
|
274
|
|
|
|
275
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
|
276
|
COCc1nnc(o1)NC(=O)CSc2[nH]ncn2
|
|
|
277
|
Cc1cc(no1)c2cc(=O)[nH]c(n2)SC
|
|
|
278
|
Cc1c(cco1)c2nnc(o2)N
|
|
|
279
|
c1c(nnn1CC(=O)[O-])CO
|
|
|
280
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
|
281
|
CN1C2C(NCCN2)N(C1=O)C
|
|
|
282
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
|
283
|
c1c2c(nc(n1)N)CCOC2
|
|
|
284
|
Cc1cc2n(n1)C(=O)CC(=O)C2
|
|
|
285
|
CCOC(=O)Cc1[nH]ncn1
|
|
|
286
|
Cc1[nH]c(=O)cc(n1)Cn2cccn2
|
|
|
287
|
c1cc(c(nc1)n2cccn2)N
|
|
|
288
|
|
|
|
289
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
|
290
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
|
291
|
C1CS(=O)(=O)N=C2N1C=CC=N2
|
|
|
292
|
c1cc(c(nc1)c2ccco2)N
|
|
|
293
|
c1cocc1c2nc([nH]n2)N
|
|
|
294
|
c1cc(oc1)c2nsc(=O)o2
|
|
|
295
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
|
296
|
CCSC1C2C(CN[NH]2)NCN1
|
|
|
297
|
c1cc(nc2c1NC(=O)C2)F
|
|
|
298
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
|
299
|
CN(C)S(=O)(=O)NCCc1c[nH]cn1
|
|
|
300
|
Cc1ccc(nn1)NCCSc2nccn2C
|
|
|
301
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
|
302
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
|
303
|
c1ccc(cc1)S(=O)(=O)[N-]c2ncccn2
|
|
|
304
|
c1cc(oc1)c2nnc(s2)N
|
|
|
305
|
c1ccc2c(c1)nc3c(n2)nc[n-]3
|
|
|
306
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
|
307
|
c1cc(oc1)c2cc(on2)N
|
|
|
308
|
Cc1ccc(cc1)S(=O)(=O)Nn2nc(nn2)c3ccccc3
|
|
|
309
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
|
310
|
c1c2c(nc(n1)N)SCC2
|
|
|
311
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
|
312
|
Cc1c(oc(n1)C)c2cc[nH]n2
|
|
|
313
|
c1c(nc(cn1)Cl)n2cncn2
|
|
|
314
|
CCOC(=O)c1[nH]nc(n1)N
|
|
|
315
|
Cc1nnc(o1)Nc2ccccc2
|
|
|
316
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
317
|
c1ccc(cc1)n2c(nnn2)n3ccnc3
|
|
|
318
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
|
319
|
C[C@@H]1COC(=N1)C2CCCCN2
|
|
|
320
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
321
|
c1(nnc(s1)S(=O)(=O)[NH-])N
|
|
|
322
|
Cc1cccc(c1NC(=O)CNc2cn[nH]n2)C
|
|
|
323
|
c1c[nH]c2c1sc(c2)C(=O)[O-]
|
|
|
324
|
Cc1c(c[nH]n1)c2nc(sn2)Nc3ccccc3
|
|
|
325
|
c1cc2c(c(cs2)N)nc1
|
|
|
326
|
c1cc(oc1C(=O)[O-])S(=O)(=O)[O-]
|
|
|
327
|
Cc1cn2c(n1)sc(n2)NCC=C
|
|
|
328
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
|
329
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
|
330
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
|
331
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
|
332
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
333
|
c1cnc2c(n1)c(cs2)N
|
|
|
334
|
c1cc(oc1)c2cc(no2)CO
|
|
|
335
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
|
336
|
C1C=Nc2c1c(=O)[nH]c(=O)[nH]2
|
|
|
337
|
c1c(cc(nc1C(=O)N)C(=O)N)[O-]
|
|
|
338
|
Cc1nc-2n(n1)CC(=Nc3c2cccc3)O
|
|
|
339
|
C=C1C=C(C(=O)Nc2ccccc2N1)O
|
|
|
340
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
|
341
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
|
342
|
CNc1c(ncnn1)C(=O)[O-]
|
|
|
343
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
344
|
Cn1c(nnc1SCC=C)Cn2cnc3c2cccc3
|
|
|
345
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
|
346
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
|
347
|
Cc1ccc(cc1)OC(=O)OCSc2[n-]nnn2
|
|
|
348
|
C1[NH+]=C2C(=N1)Nc3c(non3)N2
|
|
|
349
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
350
|
c1cc2c(cc1N)N3CC[NH+]=C3S2
|
|
|
351
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
|
352
|
c1nncn1c2[n-]c(nn2)N
|
|
|
353
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
|
354
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
|
355
|
CC(C)C1=C2CCCC[C@@H]2NC(=O)N1
|
|
|
356
|
c1cc(ccc1NC(=O)Cc2[n-]nnn2)F
|
|
|
357
|
C1CCC(CC1)CC2CCC[NH]2
|
|
|
358
|
c1ccc2c(c1)oc(=O)c(=O)o2
|
|
|
359
|
c1cc(ccc1N)Sc2nncs2
|
|
|
360
|
C1CCC(CC1)NC2=NC3C(CCCC3C(=O)[O-])C2=O
|
|
|
361
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
|
362
|
c1cn2c(=O)cc([nH]c2n1)[O-]
|
|
|
363
|
c1cc2c(c3c1noc3)nco2
|
|
|
364
|
Cc1cc(n[nH]1)Nc2ccccc2
|
|
|
365
|
c1ccc(cc1)NC(=O)C(=N2=CC=CC=C2)C#N
|
|
|
366
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
|
367
|
c1ccc2c(c1)ccc(n2)CC(=O)c3ccncc3
|
|
|
368
|
c1cc(nnc1n2cncn2)[O-]
|
|
|
369
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
|
370
|
Cc1c(nccn1)c2ccn[nH]2
|
|
|
371
|
Cc1cc(nc(n1)c2ccco2)Cl
|
|
|
372
|
COc1ccc(cc1)c2nc(c(=O)[nH]n2)Cc3ccco3
|
|
|
373
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
|
374
|
C1c2c(c(c(nc2O[C@@H]1CO)N)C#N)N
|
|
|
375
|
CC1(C(=O)N=C(N1)Nc2nc3ccccc3o2)C
|
|
|
376
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
|
377
|
CC(=O)NC1NCNC(N1)N
|
|
|
378
|
|
|
|
379
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
|
380
|
c1ccc(cc1)COc2c(nccn2)N
|
|
|
381
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
|
382
|
CCn1cc(cn1)Nc2c(cccn2)C#N
|
|
|
383
|
c1ccn(c1)c2nccs2
|
|
|
384
|
c1ccnc(c1)[C@@H]2Nc3c(c4c(s3)CCCC4)C(=O)N2
|
|
|
385
|
CCCCN(CCCC)CC#C
|
|
|
386
|
CC1NC(ON1)C2CNCCN2
|
|
|
387
|
Cc1ccc(cc1)S(=O)(=O)Oc2nc(cc(n2)C)C
|
|
|
388
|
c1cc(nn2c1ncc2)Cl
|
|
|
389
|
c1cc2c(cc1C#N)C[C@@H](O2)c3ccc(o3)Br
|
|
|
390
|
CN(C)c1nnc(o1)[C@H]2C=N[NH+]=C2N
|
|
|
391
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
|
392
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
|
393
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
|
394
|
c1cnc2c(n1)c(nnc2[O-])[O-]
|
|
|
395
|
CN(C)c1nnnn1c2ncccn2
|
|
|
396
|
c1ccc(cc1)C2=Nc3ccccc3NC=C2
|
|
|
397
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
|
398
|
C1C2C(NCN1)SC=C(N2)O
|
|
|
399
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
|
400
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
|
401
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
|
402
|
|
|
|
403
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
404
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
|
405
|
C1CNNCC1CCC(=O)[O-]
|
|
|
406
|
Cc1ccc(cc1)NC(=O)COc2nc(cs2)C
|
|
|
407
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
|
408
|
Cc1csc(n1)c2nnc(o2)N
|
|
|
409
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
|
410
|
c1ccc2c(c1)cc(c(=O)o2)C(=O)n3cccn3
|
|
|
411
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
|
412
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
|
413
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
|
414
|
c1cc(c2c(c1)ncs2)N
|
|
|
415
|
Cc1cc(no1)NS(=O)(=O)C
|
|
|
416
|
COC(=O)c1ccn(n1)CSc2nncn2N
|
|
|
417
|
CC1=NS(=O)(=O)NC(C1)(C)C
|
|
|
418
|
CNC1NNNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
419
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
|
420
|
c1ccc2c(c1)Nc3cc(=O)[nH]nc3N2
|
|
|
421
|
c1csc(n1)n2cnnn2
|
|
|
422
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
|
423
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
|
424
|
COC(=O)CCc1c[nH]cn1
|
|
|
425
|
CCCNC(=O)Cc1nc[nH]n1
|
|
|
426
|
|
|
|
427
|
CCC#CC(OCC)OCC
|
|
|
428
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
|
429
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
|
430
|
c1cc(oc1)CCC(=O)Nc2nc[nH]n2
|
|
|
431
|
COc1c2c(ncn1)CCNC2
|
|
|
432
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
|
433
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
|
434
|
c1nc(nn1CC(F)(F)F)N
|
|
|
435
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
|
436
|
COC(CNC1=Nc2c(cccn2)OC1)OC
|
|
|
437
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
|
438
|
c1cn(cn1)c2cc(=O)[nH]c(n2)N
|
|
|
439
|
C1[C@@H]2[C@H]([C@@H]([C@H]([C@H](N2C(=O)N1)O)O)O)O
|
|
|
440
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
|
441
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
|
442
|
Cn1c(=O)[nH]c(=O)c(n1)C#N
|
|
|
443
|
c1cc(oc1)c2nc(on2)CO
|
|
|
444
|
CCOC(=O)NC#CNC(=O)OCC
|
|
|
445
|
Cn1c(nnn1)c2ccco2
|
|
|
446
|
CCOC(=O)C1CC(=O)OC(=O)[NH]1
|
|
|
447
|
c1c(cn[nH]c1=O)N2CCCC2
|
|
|
448
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
|
449
|
c1cc(sc1)CSc2ccc(cc2)O
|
|
|
450
|
c1cc(sc1)C2=NS(=O)(=O)NC(=C2)C(F)(F)F
|
|
|
451
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
|
452
|
CSc1c(c([nH]n1)N)C#N
|
|
|
453
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
|
454
|
CC1C(CN2C1C(=O)[NH]CN2)[O-]
|
|
|
455
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
|
456
|
C1C[NH]C2C1C(=O)CCNC2=O
|
|
|
457
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
|
458
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
|
459
|
|
|
|
460
|
C1Cc2c(non2)-c3c1non3
|
|
|
461
|
Cn1cc(cn1)c2cnccn2
|
|
|
462
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
|
463
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
|
464
|
c1c[nH]c2c1c(ncc2)Cl
|
|
|
465
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
|
466
|
CC(C)c1nc([nH]n1)CC#N
|
|
|
467
|
Cc1c(cc(c(n1)C)C(=O)C)c2ccnc(n2)N3CCCC3
|
|
|
468
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
|
469
|
CC(C)c1c[nH]c(n1)COCc2ccccc2
|
|
|
470
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
|
471
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
|
472
|
C1N=C(N=C2N1[C@H]3[C@@H](O2)[C@@H]([C@@H](O3)CO)O)N
|
|
|
473
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
|
474
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
|
475
|
c1cc(oc1)c2c(n[n-]n2)C#N
|
|
|
476
|
c1cc(oc1)[C@@H]2C[C@@H]2C(=O)[O-]
|
|
|
477
|
CC(=O)Nc1c(cn[nH]1)C#N
|
|
|
478
|
Cn1cc(cn1)c2ccncn2
|
|
|
479
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
480
|
c1cc(ccc1F)SN2CCOCC2
|
|
|
481
|
c1ccnc(c1)SCc2[n-]nnn2
|
|
|
482
|
|
|
|
483
|
c1ccc2c(c1)CS(=O)(=O)NC2=O
|
|
|
484
|
CC1NC(C(NN1)C(=O)N)[O-]
|
|
|
485
|
C1CC(C1)c2nc(no2)CO
|
|
|
486
|
c1cnccc1c2cnc3cc(nn3c2)O
|
|
|
487
|
|
|
|
488
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
|
489
|
CCOC(=O)c1c2nc([nH]n2cn1)C(=O)C
|
|
|
490
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
|
491
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=NC(=N2)N3CCOCC3)[O-]
|
|
|
492
|
C1CCN(C1)c2c(non2)[O-]
|
|
|
493
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
|
494
|
c1cc(oc1)c2nn(c(=O)o2)CCC#N
|
|
|
495
|
c1cn2cc(nc2cn1)C(=O)[O-]
|
|
|
496
|
c1cc(cnc1)C(=O)c2ccco2
|
|
|
497
|
CCc1ccc(s1)Nc2ncnc(n2)Cl
|
|
|
498
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
|
499
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
|
500
|
C1CC(SC1)CC(=O)NC2C[NH]NC2
|
|
|
501
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
|
502
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
503
|
Cn1c(=O)c2c(c3ccccc3[nH]2)nn1
|
|
|
504
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
|
505
|
C1CCO[C@@H](C1)CS(=O)(=O)N
|
|
|
506
|
COC(=O)c1cn(nn1)CN2CCC(CC2)C#N
|
|
|
507
|
c1cc(oc1)c2cc(n[nH]2)O
|
|
|
508
|
c1ccc(cc1)Sc2ccc(o2)CO
|
|
|
509
|
C[C@@H](c1c([nH]c(=O)[nH]c1=O)[O-])[NH2+]/C=C/C2=CCCCC2
|
|
|
510
|
CC1(OC[C@@H]([C@@H](O1)[C@@H](C2[NH]C(C(N2)C#N)OC)O)O)C
|
|
|
511
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
|
512
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
|
513
|
CCc1nc(on1)Cn2c3ccccc3ncc2=O
|
|
|
514
|
C(c1c(non1)N)c2c(non2)N
|
|
|
515
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
|
516
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
|
517
|
c1ccc(cc1)c2nc(co2)Cn3cnc(n3)C#N
|
|
|
518
|
Cc1cc(nc(n1)Nn2c(cc(c(c2=O)C(=O)C)[O-])C)C
|
|
|
519
|
c1cnn(c1)Cn2cc(cn2)N
|
|
|
520
|
COC(=O)c1c(non1)n2cccc2
|
|
|
521
|
CC(=O)NCCn1cccn1
|
|
|
522
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
|
523
|
c1cc(oc1)c2c(oc(=O)o2)c3ccco3
|
|
|
524
|
CC#CC(=O)COC/C(=C/C=C)/C
|
|
|
525
|
C1C2C(NC(N1)[O-])SNN2
|
|
|
526
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
|
527
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
|
528
|
c1ccc(cc1)Nc2nnns2
|
|
|
529
|
Cc1c(c(on1)N)C2=CCCCC2
|
|
|
530
|
CS(=O)(=O)c1cnccn1
|
|
|
531
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
|
532
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
|
533
|
c1cnn2c1nc(cc2)Cl
|
|
|
534
|
c1ccc2c(c1)[C@@H]3c4cccn4CCN3C2=O
|
|
|
535
|
c1ccc(cc1)NCc2cccs2
|
|
|
536
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
|
537
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
|
538
|
CN(C)C(OCC=C)OCC=C
|
|
|
539
|
c1c[nH]c2c1NC(=O)CNC2=O
|
|
|
540
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
|
541
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
|
542
|
c1ccc2c(c1)CCNC(=O)C(=O)N2
|
|
|
543
|
c1(c(n[nH]n1)C(=O)[O-])C(=O)[O-]
|
|
|
544
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
|
545
|
c1nc(nn1CC(=O)N)C#N
|
|
|
546
|
CCn1cc(cn1)Nc2nccc(n2)OC
|
|
|
547
|
Cc1n[nH]/c(=NC(=O)CCC(=O)NC2CCCCC2)/s1
|
|
|
548
|
Cc1cc(=O)n2c(n1)nc(c(n2)C)[O-]
|
|
|
549
|
CC(=O)Oc1cc(oc(=O)c1)O
|
|
|
550
|
Cc1ccc2c(c1C)N=C3[C@H](N2)C(=O)C3=O
|
|
|
551
|
c1ccc(cc1)C2=COc3ccccc3O2
|
|
|
552
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
|
553
|
CC(=O)c1c2ccccc2[nH]c1C(=O)C
|
|
|
554
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
555
|
Cc1c(=O)n2c(nn1)sc(n2)C
|
|
|
556
|
CC[C@@H]1COC(=N1)COCC2CCCCC2
|
|
|
557
|
c1cc(oc1)Cn2c3c(nc2Cl)CCC3
|
|
|
558
|
|
|
|
559
|
c1c(c(n[nH]1)n2cnnc2)C(=O)[O-]
|
|
|
560
|
c1ccc(cc1)CCc2cnccn2
|
|
|
561
|
c1cnn2c1nnc(c2[O-])C#N
|
|
|
562
|
CNC1C(NC2C(N1)N(C(=O)N2C)C)C(=O)NC
|
|
|
563
|
CC(C)n1c(c(cn1)C#N)N
|
|
|
564
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
|
565
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
|
566
|
c12c(non1)N[C@@H]3[C@@H](N2)NC(=O)N3
|
|
|
567
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
|
568
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
569
|