(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
---|---|---|
1
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
2
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
3
|
c1c(nc(s1)c2nc[nH]n2)C(=O)[O-]
|
|
4
|
C1CCC(CC1)CN2NC(NN2)C(=O)[O-]
|
|
5
|
|
|
6
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
7
|
COCc1nnc(s1)NC(=O)c2nc[nH]n2
|
|
8
|
[H]/N=c/1[nH]nc2c(n1)-c3ccccc3C2=O
|
|
9
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
10
|
c1ccc2c(c1)nc(o2)NC3=N[C@@H](C(=N3)O)CC(=O)[O-]
|
|
11
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)N2C(=O)[NH]C(=O)O2)O)O)O
|
|
12
|
CCOC(=O)c1c([nH]cn1)SC[C@@H](C(=O)[O-])NC(=O)C
|
|
13
|
|
|
14
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
15
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
16
|
c1ncn(n1)Cc2nc([nH]n2)CC#N
|
|
17
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
18
|
c1c2c(c(n[nH]c2=O)[O-])nc(n1)N
|
|
19
|
c1ccc(cc1)C(=O)Cc2c(nn3c(nnc3n2)N)[O-]
|
|
20
|
Cc1nnc(o1)CN(Cc2nccn2C(F)F)C3CC3
|
|
21
|
c1cc(nc(c1)C(=O)N)[C@@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O
|
|
22
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
23
|
c1[nH]nc(n1)NC(=O)NC2CCCC2
|
|
24
|
Cc1cc(no1)c2c(c(no2)C)c3nc(on3)C
|
|
25
|
Cc1cc(nc(n1)SCc2ccon2)O
|
|
26
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
27
|
CNC1C(=O)NC(SN1)SC2NC(=O)C(NS2)NC
|
|
28
|
C1CN(C2C1C(NNC2)N)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
29
|
CN(C)c1nc(nc(n1)N)CN2CCNC(=O)C2
|
|
30
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
31
|
c1(c(n[nH]n1)C(=O)[O-])C(=O)[O-]
|
|
32
|
Cc1cc(n(n1)CCOc2c(non2)N)C
|
|
33
|
C1CC(OC1)C2CNC3C(N2)C(NC(N3)N)N
|
|
34
|
Cn1cnc2c1ccnc2C(=O)NCC(=O)[O-]
|
|
35
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
36
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
37
|
c1ccc(c(c1)c2nc([nH]n2)CC(=O)[O-])O
|
|
38
|
c1cc(ncc1C#N)Sc2nnc(o2)C3CC3
|
|
39
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
40
|
Cc1cnn(c1)Cc2cc(no2)C(=O)[O-]
|
|
41
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/c2[nH]ncn2)[O-]
|
|
42
|
c1ccc(cc1)SCCc2nnc(o2)N
|
|
43
|
Cc1nc(c(nn1)[O-])Cc2ccccc2
|
|
44
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
45
|
Cc1cc(=O)n2ccc3c(c2n1)oc(n3)C
|
|
46
|
Cc1c(nnn1c2nccs2)C(=O)[O-]
|
|
47
|
C1CCn2c(nnn2)[C@@H](C1)C(=O)[O-]
|
|
48
|
c1(nnc(nn1)C(=O)[O-])C(=O)[O-]
|
|
49
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
50
|
c1nc2c(c(n1)O)nnc(n2)N
|
|
51
|
Cc1nc(no1)c2c(nns2)c3ccccc3
|
|
52
|
c1cc(c(nc1)Sc2[nH]ncn2)C(=O)[O-]
|
|
53
|
Cc1nc(cs1)c2cc(no2)c3nnc(o3)[O-]
|
|
54
|
c1cc(=O)n(nc1n2cncn2)CC(=O)N
|
|
55
|
Cc1ccc(o1)c2cnnc(n2)N
|
|
56
|
c1cn2cc(nc2cn1)C(=O)[O-]
|
|
57
|
c1cnnc2c1-c3c(non3)CC2
|
|
58
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
59
|
c1nc([nH]n1)c2nc(on2)CCC(=O)[O-]
|
|
60
|
c1cc(oc1)c2cc(n3cnc(c3n2)C(=O)N)C(=O)[O-]
|
|
61
|
c1c(c(n2c(n1)ncn2)[O-])n3cncn3
|
|
62
|
C1CNC(NC1)O[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
63
|
c1ccc2c(c1)[nH]c(n2)Cn3c(nnn3)N
|
|
64
|
Cc1nc(no1)c2cccc(c2)S(=O)(=O)NCC(=O)[O-]
|
|
65
|
Cc1cc(nc(n1)Cc2ccccc2)Nc3[n-]nnn3
|
|
66
|
c1nc([nH]n1)n2c(c(nn2)CO)CO
|
|
67
|
C1C(NNN1[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
68
|
c1ccn(c1)c2[n-]c(nn2)C(=O)[O-]
|
|
69
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
70
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
71
|
C([C@@H]1[C@H]([C@@H]([C@@H](O1)C2NC(ON2)C(=O)N)O)O)O
|
|
72
|
c1ccc(cc1)S(=O)(=O)/N=C(/Cc2ccc(nc2)C(=O)[O-])[O-]
|
|
73
|
c1c(c(n[nH]c1=O)[O-])CC(=O)[O-]
|
|
74
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
75
|
c1cc(oc1)CN2C(=O)[C@@H](N=C2O)CCC(=O)[O-]
|
|
76
|
Cc1c(non1)OCCOc2c(non2)C
|
|
77
|
Cc1nnc(o1)CSc2nc([nH]n2)N
|
|
78
|
c1ccc(cc1)S(=O)(=O)Nc2[n-]cnn2
|
|
79
|
c1(c(non1)C(=O)[O-])c2c(non2)C(=O)[O-]
|
|
80
|
CSc1nc(sn1)NC(=O)c2nc[nH]n2
|
|
81
|
c1cocc1c2nc(no2)C(=O)[O-]
|
|
82
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
83
|
CC(=O)N[C@H]1c2nc(cn2[C@@H]([C@H]([C@@H]1O)O)CO)CC(=O)[O-]
|
|
84
|
CNc1c2c(nccn2)ncn1
|
|
85
|
CCOc1c(nc(o1)c2ccco2)C(=O)[O-]
|
|
86
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
87
|
Cn1c2c(c(=O)[nH]c1=O)non2
|
|
88
|
CCc1nc(cs1)Cn2cnc(n2)C#N
|
|
89
|
C1CCC2C(C1)C(NO2)CC3[N-]NNN3
|
|
90
|
c1cc(nn2c1nnn2)n3cnc(n3)C#N
|
|
91
|
c1conc1c2c(nco2)C(=O)[O-]
|
|
92
|
Cc1cc([nH]c1c2ccn(n2)C(=O)c3c(nns3)C)C
|
|
93
|
Cc1nc(on1)CCCc2c[nH]c3c2cccc3
|
|
94
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
95
|
Cc1nnc(o1)COC(=O)c2c(nccn2)N
|
|
96
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
97
|
c1cc(oc1Cc2c(=O)[nH]cnc2[O-])C(=O)[O-]
|
|
98
|
Cc1c(c(noc1=O)C)c2ccc(c(c2)C(=O)[O-])Cl
|
|
99
|
Cn1c(nnn1)Sc2ccncc2S(=O)(=O)N
|
|
100
|
c1c(n[n-]n1)SCC(=O)Nc2nncs2
|
|
101
|
CN[S@@](=O)NC1CC[NH]C(=O)N1
|
|
102
|
Cc1nc(cs1)CSc2nc([nH]n2)N
|
|
103
|
Cc1cc(nc2c1c(=O)nc3n2ncs3)C
|
|
104
|
c1ccnc(c1)n2c(=O)c(=O)[nH]cn2
|
|
105
|
CC1=C(NC(=O)NN1)/N=C/2C=CC=CC2=O
|
|
106
|
c1cc2c(c3c1nncc3)non2
|
|
107
|
c1cc(oc1)C(=O)NC/C(=N/c2[nH]ncn2)/[O-]
|
|
108
|
CCOC(=O)Cc1nc(no1)c2nnc(o2)N
|
|
109
|
C1NC2C(C(N1)N)SNC2[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
110
|
CC(C)NC(=O)CSc1cnnn1c2ccccc2F
|
|
111
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
112
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
113
|
Cc1cc2c(c(n[nH]c2=O)N)c(=O)[nH]1
|
|
114
|
c1cc2c(c(c1)S(=O)(=O)N)non2
|
|
115
|
Cc1ccc(cc1)S(=O)(=O)n2c(nnn2)[O-]
|
|
116
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
117
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
118
|
Cn1c(ccn1)c2c(snn2)C(=O)[O-]
|
|
119
|
c1cnc(c(n1)C#N)n2ccnc2
|
|
120
|
Cc1nnc(o1)c2csc(n2)c3cccnc3
|
|
121
|
c1cc(cnc1)c2cn3c(c(n2)N)nc(n3)c4ccco4
|
|
122
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
123
|
c1ccc(cc1)COc2c(nccn2)N
|
|
124
|
CC[C@@H]1C2=C(CN(C2=O)CC(=O)[O-])NC(=O)N1
|
|
125
|
CCOC(=O)[C@@H](c1ccccc1)Sc2cn[nH]n2
|
|
126
|
c1nc2c(c(n1)[O-])nsc2C(=O)[O-]
|
|
127
|
Cc1c2c(ccnc2c3c(n1)non3)[O-]
|
|
128
|
C/C=C(/[C@H]1C(=NC(=NC1=O)O)O)Nc2ccc(cc2)F
|
|
129
|
CC1C(C(NC(N1)C)CC2C3CCCCC3NCN2)CL
|
|
130
|
c1ccc(cc1)n2c(=O)c(nc(n2)C(=O)[O-])N
|
|
131
|
c1cc(oc1)[C@@H]2Cc3c(cn[nH]3)C(=O)C2
|
|
132
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
133
|
CC(=O)N[C@@H](CS/N=N/c1c(nc[nH]1)C(=O)N)C(=O)[O-]
|
|
134
|
CCOc1nnc(o1)[N-]S(=O)(=O)c2ccc(cc2)N
|
|
135
|
c1cc(oc1CSc2[nH]cnn2)C(=O)[O-]
|
|
136
|
Cc1c(c2nnnn2c(n1)c3ccccn3)Cl
|
|
137
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
138
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
139
|
COC(=O)c1cnn2c1NCN(C2)Cc3ccco3
|
|
140
|
Cc1ncc(c(n1)N)CSc2nc(ns2)SC
|
|
141
|
CCOC(=O)C1=NC(=O)N=C1Cn2ccnc2
|
|
142
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
143
|
COc1ccnc(n1)Sc2nnc(s2)SC
|
|
144
|
CCOC(=O)Cn1c(nnn1)c2c(non2)N
|
|
145
|
c1c(c(c(=O)n(n1)Cc2ncno2)Cl)Cl
|
|
146
|
Cn1cc(cn1)c2c(nco2)C(=O)[O-]
|
|
147
|
C1Cc2c(non2)-c3c1non3
|
|
148
|
CC(=O)NCC1CNCCN1
|
|
149
|
CN(Cc1ccc(cc1)C#N)Cn2cc(cn2)Cl
|
|
150
|
c1cc2c(nc1)Nc3c(c(=O)nc([nH]3)N)S2
|
|
151
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
152
|
CC(=C)CSc1nnc(o1)Cn2cncn2
|
|
153
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
154
|
Cc1ccc(cc1)Sc2c(c([nH]n2)N)NC(=O)C
|
|
155
|
C(c1c(non1)N)c2c(non2)N
|
|
156
|
Cc1c(c(=O)[nH]c(n1)[O-])S(=O)(=O)CCC(=O)[O-]
|
|
157
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
158
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
159
|
C(Oc1c(non1)N)Oc2c(non2)N
|
|
160
|
Cc1c(cnc(n1)N)c2ccccn2
|
|
161
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
162
|
c1c(c([nH]n1)C(=O)[O-])n2cnnc2
|
|
163
|
CCc1nc(cs1)CNCc2nc(no2)C
|
|
164
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
165
|
c1cnc(nc1)N2CCC[C@H]2c3nc(no3)c4cncnc4N
|
|
166
|
C[C@@H](Cc1nc(on1)C(=O)[O-])n2cccn2
|
|
167
|
C(C1[N-]NNN1)C2[N-]NNN2
|
|
168
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
169
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
170
|
Cc1nc(no1)COc2ccc(cc2)N
|
|
171
|
c1cc(cnc1)C2=C[C@](C[C@H]([C@@H]2O)O)(C(=O)[O-])O
|
|
172
|
CSc1c(c([nH]n1)N)C#N
|
|
173
|
c1ccnc(c1)NC(=O)Cn2cnnn2
|
|
174
|
C(C(=O)[O-])Sc1nc(=O)c(ns1)[O-]
|
|
175
|
|
|
176
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
177
|
Cc1[nH]c(=O)cc(n1)CSc2nncn2C
|
|
178
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
179
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
180
|
c1cc(oc1)C(=O)Nc2nc(co2)C(=O)[O-]
|
|
181
|
c1nncn1c2[n-]c(nn2)N
|
|
182
|
CCOC(=O)c1cc(no1)c2c(non2)N3CCOCC3
|
|
183
|
c1ccc(cc1)[C@@H]2CC(=O)Nc3c2snc3C(=O)[O-]
|
|
184
|
c1ccc(cc1)CSc2cncc(n2)C(=O)[O-]
|
|
185
|
C(#N)c1c(n2c(c(nnc2n1)C(=O)N)N)C#N
|
|
186
|
c1ccc(cc1)c2c3c(ccnc3c4c(n2)non4)[O-]
|
|
187
|
c1ccn2cc(c(c2c1)C#N)CSc3[nH]ncn3
|
|
188
|
c1cc(ccc1Cc2nc(on2)N)F
|
|
189
|
C1CC(OC1)NC(=O)CCC(=O)[O-]
|
|
190
|
c1cnn(c1)c2ccc(nn2)[O-]
|
|
191
|
c1ccc(cc1)COc2c(non2)N
|
|
192
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
193
|
Cc1nc(no1)Cn2cnc(n2)C(=O)N
|
|
194
|
Cc1nnc(o1)CNC(=O)C2CCC2
|
|
195
|
Cc1nc([nH]n1)SCc2nc(nc(n2)N)N
|
|
196
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
197
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
198
|
C[C@@H]1[C@@H]([C@H]([C@@H](C(=N1)CO)O)O)O
|
|
199
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
200
|
Cc1cc(nc(n1)n2c(=O)ccc(n2)[O-])C
|
|
201
|
Cc1csc(n1)[C@@H](C#N)C(=O)Cn2cnc(n2)C#N
|
|
202
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
203
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
204
|
c1cnccc1C2c3c(c(n[nH]c3=O)[O-])Nc4c2c(=O)[nH]nc4[O-]
|
|
205
|
c1cc(oc1)c2c[nH]c(=O)cn2
|
|
206
|
c1ccc2c(c1)ncn2Cn3ccc(n3)C(=O)[O-]
|
|
207
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
208
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
209
|
c1c(nc(cn1)Cl)n2cncn2
|
|
210
|
C1[C@H](O[C@H]([C@@H]1O)CO)CN2[C@@H](N=C3C2=NC(=NC3=O)[NH-])O
|
|
211
|
Cc1cc2nc(nc(=O)n2o1)Oc3ccccc3
|
|
212
|
C1NC2C(C(N1)[O-])NC(NN2)[O-]
|
|
213
|
C(C#N)C1C(NN(N1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O)C(=O)N
|
|
214
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
215
|
c1cc(cnc1)Cc2c3[nH]c4c(c(=O)n3[nH]c2=O)CCC4
|
|
216
|
[H]/N=c/[nH]nc(s1)Sc2c(nc(nn2)O)O
|
|
217
|
c1cc(c2c(c1)sc(n2)Nc3nnc(o3)c4ccco4)F
|
|
218
|
C[C@@H]1COCCN1Cn2c(=O)cc3c(n2)CCC3
|
|
219
|
c1ccc(cc1)Oc2ccc(nn2)[O-]
|
|
220
|
Cc1nc(n(n1)c2ncccn2)Cl
|
|
221
|
CC(=O)Nc1nc(cs1)Cn2c(noc2=O)c3ccccc3
|
|
222
|
CCC1NC(ON1)COC(=O)C2CC[NH]N2
|
|
223
|
Cc1cc(=O)n([nH]1)c2[n-]nnn2
|
|
224
|
c1cc(cnc1)C2=C3C(=CC(=N3)C(=O)[O-])OC2
|
|
225
|
Cc1nc(cs1)c2nc(cs2)C(=O)C
|
|
226
|
c1cn(c(=O)c(=O)[nH]1)CCC(=O)[O-]
|
|
227
|
C[C@@H](c1ccnc(n1)N)n2cncn2
|
|
228
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
229
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
230
|
COCc1nc(cs1)Cc2nnc(o2)N
|
|
231
|
c1csc(c1C#N)n2cc(c(=O)[nH]c2=O)C#N
|
|
232
|
c1cnc2c(n1)C(=O)NCN2
|
|
233
|
c1ccnc(c1)CCSc2nncs2
|
|
234
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
235
|
c1cnn2c1c(=O)n(nc2)CC(=O)[O-]
|
|
236
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
237
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
238
|
c1cnn(c1)Cc2nn3c(nnc3s2)C4CC4
|
|
239
|
COC(=O)C[C@@]1(C(=C(C(=N1)[O-])N)C(=O)OC)C(=O)OC
|
|
240
|
Cc1cc(c(=O)n(c1)Cc2cccc(c2)F)NS(=O)(=O)C
|
|
241
|
CC1=CC(=NC2=NNC(=O)[C@@H]12)C(=O)[O-]
|
|
242
|
Cc1nnc(o1)CSc2nccn2C
|
|
243
|
Cc1cc(on1)c2c(nco2)C(=O)[O-]
|
|
244
|
c1ccc2c(c1)nc(s2)CSc3[nH]ncn3
|
|
245
|
Cn1c-2n/c(=NCc3ccccc3)/n(c2c([nH]c1=O)[O-])CC(=O)[O-]
|
|
246
|
CSc1nnc(s1)Sc2c(nccn2)C#N
|
|
247
|
Cc1cc(nc(n1)SNc2ccccc2OC)C
|
|
248
|
CCOc1nnc(s1)Cn2c(noc2=O)c3ccccc3
|
|
249
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
250
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
251
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
252
|
c1cnn2c1ncc3c2C(=O)OCC3
|
|
253
|
c1cc(oc1C(=O)[O-])S(=O)(=O)[O-]
|
|
254
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
255
|
Cc1nnc(s1)SCC2=NN(C(=O)C2)c3ccccc3
|
|
256
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
257
|
c1c(c(n[nH]1)n2cnnc2)C(=O)[O-]
|
|
258
|
Cc1nc(no1)Cn2c(=O)n(nn2)c3ccccc3
|
|
259
|
CCCC(=O)/[NH+]=c/cc(c-2c(oc3ccccc3c2n1)O)C
|
|
260
|
Cc1cc(no1)c2nnc(o2)N
|
|
261
|
Cc1c(cnc(c1C#N)N)Cc2cc(ccc2OC)OC
|
|
262
|
c1cc(nnc1n2cncn2)[O-]
|
|
263
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
264
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
265
|
c1cc(c2c(c1C3=CCCc4c3non4)non2)N
|
|
266
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
267
|
|
|
268
|
c1ccc2c(c1)[C@@H](OC2=O)c3c(c(=O)cc(o3)CO)O
|
|
269
|
CC1NCC2C(N1)C(NC(N2)N)[O-]
|
|
270
|
CN(C)c1nc(nc(n1)N)Cn2c(=O)c3ccccc3cn2
|
|
271
|
c1c[nH]c(=O)nc1NC(=O)c2nc[nH]n2
|
|
272
|
c1cnc(c2c1n(nn2)[C@@H]3C[C@@H](OC3)CO)N
|
|
273
|
Cn1c(=O)ccn(c1=O)C/C(=N/c2[nH]ncn2)/[O-]
|
|
274
|
c1ccnc(c1)/C(=N/c2n[nH]nn2)/[O-]
|
|
275
|
CC1C(OC(N1)CSC2[NH]NCN2)C
|
|
276
|
Cn1cc(c(n1)C(=O)Nc2[nH]ncn2)C(=O)[O-]
|
|
277
|
COc1ccc(cc1)[C@@H]2C(=NC(=O)N2)c3ccc(cc3)OC
|
|
278
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
279
|
C1/C(=CC(=O)[O-])/[C@@](OC1=O)(CCC(=O)[O-])O
|
|
280
|
Cc1ccc(cc1)SCC(=O)n2cnnc2N
|
|
281
|
Cc1ccccc1C=C2C(=O)NC(=O)NC2=O
|
|
282
|
CC1NC(ON1)C2CNCCN2
|
|
283
|
CC1=C(C(=O)NC2=NNC(=O)[C@@H]12)CCC(=O)[O-]
|
|
284
|
c1cnc(nc1)SCc2cc(=O)c(co2)O
|
|
285
|
c1c[nH]nc1C(=O)NC2CC2
|
|
286
|
Cc1nc(on1)[C@@H](C)Nc2nccc(n2)OC
|
|
287
|
C1NC([NH]N1)CCCS(=O)(=O)[O-]
|
|
288
|
C1CCC(CC1)COC(=O)N[C@@H](CC(=O)N)C2[N-]NNN2
|
|
289
|
|
|
290
|
Cc1c(cc(o1)c2ccno2)S(=O)(=O)NC
|
|
291
|
c1c(sc(n1)Cl)Cn2cc(nn2)CO
|
|
292
|
c1ccc(c(c1)NC(=O)[C@@H]2CC(=O)N=C3[C@@H]2C(=O)CCC3)F
|
|
293
|
CC(=O)O[C@@H](c1ccccc1)C(=O)Nn2c(nnn2)N
|
|
294
|
c1cc(=O)n(nc1)CC(=O)[O-]
|
|
295
|
COC(=O)c1c2c(c(s1)SCC(=O)[O-])[nH]cn2
|
|
296
|
CCSc1nnc(n1C)CSc2c([nH]c3c2cccc3)C
|
|
297
|
C1=NC(=O)C2=NC(=NC2=N1)[N-]NSCCO
|
|
298
|
c1ccnc(c1)NS(=O)(=O)c2ccc(o2)C(=O)[O-]
|
|
299
|
Cc1cnn(c1)CC/C(=N/c2[nH]ncn2)/[O-]
|
|
300
|
c1cc(oc1)c2ccnc3n2ncc3
|
|
301
|
Cc1csc(n1)c2c(non2)N
|
|
302
|
CC(=O)Nc1nnc(s1)c2c(non2)N
|
|
303
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
304
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
305
|
c1ccc(cc1)c2c[nH]c3c2c(ncn3)N
|
|
306
|
CN(C)C1NC(SN1)C(=O)C2C[NH]C3C2CCCC3
|
|
307
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
308
|
C1CNc2nc(nn2C1)C(=O)[O-]
|
|
309
|
Cc1cccc(c1)Sc2ccnc(n2)c3ccccn3
|
|
310
|
c1cnnc(n1)c2nccnn2
|
|
311
|
|
|
312
|
C(#N)c1c(non1)Oc2c(non2)C#N
|
|
313
|
[C@H]12[C@H]([C@@H]1C(=O)[O-])C(=O)N=C2[O-]
|
|
314
|
|
|
315
|
c1cnccc1c2cc3n(n2)CCNC3=O
|
|
316
|
C1CC(CCC1SCC2CNC(C(N2)C#N)N)CL
|
|
317
|
c1coc2c1-c3c(cnc(n3)N)CC2
|
|
318
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
319
|
C(c1nnc(o1)N)c2nnc(o2)N
|
|
320
|
c1ccc(cc1)S(=O)(=O)Nc2nncs2
|
|
321
|
C12C(NC(S1)C(=O)[O-])SC(N2)C(=O)[O-]
|
|
322
|
Cc1cc(no1)c2nn3cnnc3s2
|
|
323
|
CC(=O)n1ccc(n1)C(=O)[O-]
|
|
324
|
C[C@@H]1C=C([C@H]2C(=N[NH+]=C2N1)c3ccccc3)C
|
|
325
|
CC(=O)Nc1nnc(s1)Sc2cnccn2
|
|
326
|
CCCc1nnc(o1)NS(=O)(=O)c2ccc(cc2)C
|
|
327
|
Cc1c2c(con2)c(nn1)c3ccccn3
|
|
328
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
329
|
Cc1cc(nc(n1)N2C(=O)CC(=N2)N)C
|
|
330
|
Cc1nc(cs1)c2nc(nc(n2)OC)N
|
|
331
|
CC1CC(=O)CC(O1)C(=O)[O-]
|
|
332
|
CCOC(=O)C1=C(NC(=O)NC1)CSC2[NH]NCN2
|
|
333
|
c1cc(oc1)C(=O)Nc2nc[nH]n2
|
|
334
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
335
|
C[C@@H]1C2C(CC(NC2[O-])OC(=O)C)C(=N1)OC(=O)C
|
|
336
|
C1[NH]C2C(N1)NCNC2SC3=NCCN3
|
|
337
|
c1cc(nn2c1nnn2)n3ccnc3
|
|
338
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
339
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
340
|
COCCCn1cnc2c(c1=O)c3c(o2)nc4ccccc4n3
|
|
341
|
CCc1c(cccn1)C(=O)[O-]
|
|
342
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
343
|
Cc1cc(no1)CNc2nccc(n2)OC
|
|
344
|
CC(C)C(=O)/N=c/1[nH]cnc2n1ncn2
|
|
345
|
c1cc2c(cc1Cn3cnnc3)OCO2
|
|
346
|
CC(C)(C(=O)[O-])n1cncn1
|
|
347
|
C1CC(C1)c2nc(no2)CO
|
|
348
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
349
|
c1ccc2c(c1)c(=O)c(c[nH]2)C(=O)Nc3nccs3
|
|
350
|
Cc1c(=O)[nH]c(nn1)n2c(=O)ccc(n2)[O-]
|
|
351
|
c1ccc(cc1)c2nc(no2)c3nnc(o3)N
|
|
352
|
C1CCC(CC1)N2CC(=C(C2=O)[O-])C(=O)N
|
|
353
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
354
|
COC(=O)c1c(ccs1)n2cc(c(=O)[nH]c2=O)C#N
|
|
355
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
356
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
357
|
Cn1c2c(cnc(n2)c3cccnc3)c(=O)nc1[O-]
|
|
358
|
Cc1cc(n(n1)c2nc(nc(n2)N)C)C
|
|
359
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
360
|
CC1NC2C(NCNC2NN1)N
|
|
361
|
C1CCc2nn3c(n2CC1)c(c(nc3=O)SCC(=O)N)C#N
|
|
362
|
C1CCC(CC1)C2NOC(=O)N2CC3CN4CCSC4N3
|
|
363
|
C1CCC2C(C1)C(NO2)C[S@@](=N)(=O)[O-]
|
|
364
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
365
|
Cc1cc(nc(n1)c2csc(n2)C)NC
|
|
366
|
c1ncn(n1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
367
|
CCOc1nnc(s1)Cn2c(=O)c(c(c(n2)C)C)C#N
|
|
368
|
C/C(=N/c1nnc2n1NC(=C)C=C([NH2+]2)[O-])/O
|
|
369
|
c1ncn(n1)NCNn2cncn2
|
|
370
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
371
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
372
|
|
|
373
|
c12c([nH]c(=O)nc1onn2)[O-]
|
|
374
|
c1[nH]c(c(n1)C(=O)N)Sc2c(nns2)C(=O)N
|
|
375
|
CCc1nnc(o1)Cn2c(=O)n(nn2)c3ccccc3
|
|
376
|
C(#N)c1c([nH]c(n1)N)C(=O)N
|
|
377
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
378
|
c1ccc(cc1)c2nc(c3n2CCCCC3)C(=O)[O-]
|
|
379
|
c1ccc(cc1)Oc2[nH]nnn2
|
|
380
|
Cc1nc(on1)CNS(=O)(=O)C
|
|
381
|
Cc1cc(c(o1)C)c2csc(n2)NC(=O)C
|
|
382
|
COc1ccc(nc1c2cnc[nH]2)C(=O)[O-]
|
|
383
|
c1cc(oc1)c2[nH]c3cnn(c3n2)C4CCCC4
|
|
384
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
385
|
Cc1cc(nc(n1)Nn2c3ccccc3[nH]c2=O)C
|
|
386
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
387
|
c1c(nc2c(n1)c(ncn2)[O-])[O-]
|
|
388
|
Cn1c(c(c(=O)n(c1=O)C)C(=O)c2cc(on2)c3ccco3)[O-]
|
|
389
|
|
|
390
|
c1ccc(c(c1)Nc2c3c([nH]cn3)ncn2)O
|
|
391
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
392
|
CCOC(=O)NC1[NH]N(C(=O)N1)C2CCCCN2
|
|
393
|
Cn1c(ccn1)c2cc(no2)C(=O)[O-]
|
|
394
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
395
|
c1ccc(cc1)CN2CCc3c(c(n4c(n3)ncn4)[O-])C2
|
|
396
|
CNCCS/C1=NC(=O)CN2CNNN2
|
|
397
|
c1c[nH]nc1c2nn3cnnc3s2
|
|
398
|
c1cc(cnc1)n2c3c(ccc4c3cn[nH]4)c(n2)C(=O)N
|
|
399
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
400
|
c1cc(ccc1c2nnnn2c3cnccn3)Cl
|
|
401
|
c1cnc(cn1)NC2=NCCN2
|
|
402
|
CNC(=O)OCC#CCOC(=O)NC
|
|
403
|
Cc1nc(on1)NC(=O)CSc2nncn2C3CC3
|
|
404
|
Cc1cc(n(n1)c2nc(nc(n2)OC)n3c(cc(n3)C)C)C
|
|
405
|
c1nc2nc(nc(n2n1)N)[O-]
|
|
406
|
c1cc2c(cc1F)N=C3[C@H](N2)C(=O)C3=O
|
|
407
|
CN(C)c1nnnn1c2ncccn2
|
|
408
|
c1ccc(cc1)c2cc(nc(n2)C(=O)Nc3[n-]nnn3)O
|
|
409
|
Cc1nc(cs1)CNc2nccc(n2)OC
|
|
410
|
c1c(c(=O)[nH]c(=O)n1O[C@@H]2[C@@H]([C@@H]([C@@H](O2)CO)O)O)F
|
|
411
|
c1cnc(nc1)Sc2cnnc(c2Cl)[O-]
|
|
412
|
CCS(=O)(=O)n1c(cc(n1)c2ccccc2)N
|
|
413
|
CC(=O)NC1NCNC(N1)N
|
|
414
|
c1c2c([nH]c1C(=O)[O-])nco2
|
|
415
|
CCOC(=O)N1CCC2C([NH]OC2=O)CC1
|
|
416
|
Cn1c(=O)c2c3c(c[nH]n3)oc2n(c1=O)C
|
|
417
|
C=CCN(Cc1nccn1C(F)F)C2CC2
|
|
418
|
C1NC-2C3NN[N-]N3CNC2N1
|
|
419
|
c1ccc(cc1)Nc2nc(cnn2)[O-]
|
|
420
|
c1ccc2c(c1)[nH]c(n2)Cn3cncn3
|
|
421
|
CS(=O)(=O)Nc1cccn2c1ncn2
|
|
422
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
423
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
424
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
425
|
CC(=O)/N=c/c(nn(s1)C(=O)C)C(=O)N
|
|
426
|
CC(C)CN1C[C@@H](CC1=O)/C(=N/c2[nH]ncn2)/[O-]
|
|
427
|
c1cc(ccc1C(=O)COC(=O)CCn2cnnn2)F
|
|
428
|
C1Cc2c(non2)C(=O)NC1
|
|
429
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
430
|
c1ccc2c(c1)CC3=C2NC(=O)N[C@@H]3c4ccccn4
|
|
431
|
c1coc2c1[C@@H](CCC2)NC(=O)c3cnccn3
|
|
432
|
Cc1cc(no1)Cn2cnc(n2)C#N
|
|
433
|
c1c([nH]cn1)CCNC(=O)C2=NC=NC2
|
|
434
|
C1C[C@@H](OC1)C(=O)Nc2[n-]nnn2
|
|
435
|
C[C@@H]1c2cccn2CCN1c3c4cn[nH]c4nc(n3)N
|
|
436
|
C(C#N)c1nc(nc(n1)N)N
|
|
437
|
c1cc2c(nc1C#N)CCCN2
|
|
438
|
|
|
439
|
Cc1c(c(n[nH]1)n2cnnc2)c3ccc(cc3)OC
|
|
440
|
c1ccc(cc1)c2nc(on2)SCC(=O)[O-]
|
|
441
|
|
|
442
|
CNC1C(=O)NC(SN1)N2CNC3C2CCCC3
|
|
443
|
|
|
444
|
C=Cc1nc(cs1)C(=O)[O-]
|
|
445
|
c1cc2cn[nH]c2c(c1)S(=O)(=O)[O-]
|
|
446
|
Cn1c(=O)cc(nc1SCc2nc3ccccc3c(=O)o2)[O-]
|
|
447
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
448
|
COc1nc(nc(n1)Sc2ccc(cc2)N)OC
|
|
449
|
Cc1c(non1)COc2ccc(cc2)C(=O)[O-]
|
|
450
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
451
|
CCC1NC(NO1)CSC2[NH]NCN2
|
|
452
|
Cc1c(nn2c(=O)c(nnc2n1)C)[O-]
|
|
453
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
454
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
455
|
c1ccc2c(c1)nnn2c3cnccn3
|
|
456
|
c1c2c(nc(nc2oc1C(=O)[O-])C(F)(F)F)[O-]
|
|
457
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
458
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
459
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
460
|
c1nnc(s1)NC(=O)[C@H]2C(=C3CCCCC3=NC2=O)[O-]
|
|
461
|
c1cc2ccn(c2nc1)CC(=O)[O-]
|
|
462
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
463
|
c12c(non1)N=C3C(=Nc4c(non4)N3)N2
|
|
464
|
CSc1nc2ncnn2c(n1)[O-]
|
|
465
|
c1c(nnn1CC(=O)[O-])CO
|
|
466
|
C([C@@H](CO)O)N1C(=O)SC(N1)N
|
|
467
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
468
|
CC1=C(OS(=O)(=O)N=C1[O-])C2CCCCC2
|
|
469
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
470
|
Cc1cc(n(n1)C(=O)[C@@H]2[C@@H]3CC[C@H]([C@@H]2C(=O)[O-])O3)C
|
|
471
|
Cc1[nH]c(=O)c2c3c(c(=O)oc2n1)nns3
|
|
472
|
CC1(Cc2c(oc3c2c(ncn3)N)CO1)C
|
|
473
|
CS(=O)(=O)Nc1ncccn1
|
|
474
|
Cc1cc(no1)/N=C/Cc2nnnn2c3ccccc3
|
|
475
|
Cc1c(=O)nc-2n(n1)[C@@H](Nc3c2cccc3)C(=O)[O-]
|
|
476
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
477
|
C[C@@H]1C(=O)N=C(N1c2nc(nc(n2)OC)NC(C)C)N
|
|
478
|
|
|
479
|
c1[nH]c(c(n1)N)c2[nH]oc(=O)n2
|
|
480
|
c1ccc(cc1)N2CC(=C(N)N)C(=NC2=O)[O-]
|
|
481
|
CCn1c2c(con2)c(=O)[nH]c1=O
|
|
482
|
Cc1c(oc(n1)Sc2ccc3nnnn3n2)C
|
|
483
|
CCOC1NC(=O)N(S1)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
484
|
c1ccc(cc1)OCCS(=O)(=O)[O-]
|
|
485
|
|
|
486
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
487
|
|
|
488
|
c1ccc(cc1)Cn2cnnn2
|
|
489
|
CC1C2NNNN2C(=O)N(N1)C3CCCCC3
|
|
490
|
C1=CC2=NNC(=O)[C@@H]2C=C1C(=O)[O-]
|
|
491
|
c1cnc(c(n1)C(=O)Nc2[n-]ncn2)C(=O)[O-]
|
|
492
|
C1(=NS(=O)(=O)N=C1C(=O)[O-])C(=O)[O-]
|
|
493
|
COc1ccc(cc1)/N=c/c3ccccc3[nH]c(=O)cn2
|
|
494
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
495
|
CC(C)(C)C(=O)OCn1c(noc1=O)c2cccnc2
|
|
496
|
c1cc(oc1)c2ccnc3c2c(=O)[nH]c(=O)[nH]3
|
|
497
|
c1cc(sc1)Sc2c(nccn2)C#N
|
|
498
|
c1cc2cccc-3c2c(c1)-c4c3nnc(n4)[O-]
|
|
499
|
c1cc(ccc1C(=O)[O-])/N=N/SCCO
|
|
500
|
c1[nH]nc(n1)C(=O)NC2CC2
|
|
501
|
c1ccnc(c1)n2ccnc2C(=O)c3ccco3
|
|
502
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
503
|
Cc1cc(nc(n1)SCc2nnc(s2)NC)C
|
|
504
|
Cn1nc(nn1)[C@@H](CNCc2cccs2)O
|
|
505
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
506
|
Cc1ccc(cc1)NC(=O)c2nnc(s2)Cn3ccnc3
|
|
507
|
CC[C@@H](C(=O)/N=c/1[nH]cn[nH]1)Oc2ccccc2
|
|
508
|
CCc1cnnn1c2c(non2)N
|
|
509
|
Cc1cc(n(n1)c2nc(c(nn2)C)[O-])C
|
|
510
|
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)[O-])c2ccco2
|
|
511
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
512
|
Cc1ncc2c(n1)NC(=O)NC2
|
|
513
|
Cc1cc(n(n1)c2nc3ccccc3o2)N
|
|
514
|
c12c(c(n[nH]c1=O)[O-])non2
|
|
515
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
516
|
CS(=O)(=O)/N=C(/c1ccc(nc1)C(=O)[O-])[O-]
|
|
517
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
518
|
c1ccc(cc1)C2=CC=CC(C2(O)O)(O)O
|
|
519
|
c1c(nc2cnnn2c1[O-])[O-]
|
|
520
|
c1ccc2c(c1)nc(o2)c3c(non3)N
|
|
521
|
Cc1cc(n(n1)C(=O)c2c(nns2)C)C
|
|
522
|
Cc1c2c(c(nn1)C)c(nnc2[O-])[O-]
|
|
523
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
524
|
CCN(CC)c1nc(nc(n1)N(CC)CC)c2[n-]nnn2
|
|
525
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
526
|
c1ccc2c(c1)Nc3c(nc4c(n3)non4)N2
|
|
527
|
c1ccc(cc1)C/N=c/c(=N/CCO)/c(c2O)O
|
|
528
|
c12c(n[nH]n1)Nc3c(non3)N2
|
|
529
|
Cc1cc(nc(n1)Nc2[nH]ncn2)C
|
|
530
|
c1cc(ccc1N)Sc2nncs2
|
|
531
|
c1cocc1C(=O)OCc2nc(nc(n2)N)N
|
|
532
|
CS(=O)(=O)Nc1cccc2c1cn[nH]2
|
|
533
|
c1ccc2c(c1)nnn2Cc3csnn3
|
|
534
|
CCS(=O)(=O)c1ccc(c(c1)n2c(c[nH]c2=O)O)OC
|
|
535
|
Cc1cc(nc(n1)N2CC(=O)N=C2N)C
|
|
536
|
C1CCC(CC1)C2NNC3N2NC(O3)C4CCCO4
|
|
537
|
C1CCC(C1)C(=O)Nc2[n-]nnn2
|
|
538
|
c1ccc(cc1)C(=O)NCn2cncn2
|
|
539
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
540
|
CCNC(=O)NC1=NC(=O)[C@@H](O1)C(C)C
|
|
541
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
542
|
Cc1c(oc(n1)C)c2ccnc(n2)N
|
|
543
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
544
|
Cc1c(c(on1)C)Cc2ccc(s2)C(=O)[O-]
|
|
545
|
Cc1c(c(n(n1)C)C)Nc2nc([nH]n2)N
|
|
546
|
CCS(=O)(=O)N1CC=C[C@@H]1C(=O)NC2CC2
|
|
547
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
548
|
|
|
549
|
CC1CC(N(N1)C2CC(NNC2)[O-])C
|
|
550
|
c1ccc(cc1)c2cnccn2
|
|
551
|
Cc1cc(on1)CCCOc2ccc(cn2)C#N
|
|
552
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
553
|
c1cnccc1c2cnc3cc(nn3c2)O
|
|
554
|
|
|
555
|
Cc1cc(nn2c1nnc2)n3ccnc3
|
|
556
|
CCS(=O)(=O)NCc1nnc(o1)C
|
|
557
|
CC(C)(C)OC(=O)NS(=O)(=O)Nc1nccs1
|
|
558
|
Cc1c(nn(c(=O)c1C#N)Cc2nc3ccccc3o2)C
|
|
559
|
c1ccc(cc1)CC2=C(C=NC(=O)C2)C(=O)N
|
|
560
|
|
|
561
|
CC1C(NC2C(N1)C(NNC2N)N)C
|
|
562
|
COc1cc(=O)nc(o1)c2ccco2
|
|
563
|
c1nc(nn1Cc2c(snn2)Cl)C#N
|
|
564
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
565
|
C1CCC(C1)NC2C(C(NNN2)N)N
|
|
566
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
567
|
CC1(OC[C@@H]([C@@H](O1)[C@@H](C2[NH]C(C(N2)C#N)OC)O)O)C
|
|
568
|
c1cc(c(nc1)n2cncn2)N
|
|
569
|
c1cc(oc1Cn2ccnc2)C(=O)[O-]
|
|
570
|
Cc1c(non1)c2c3c(non3)n(n2)C(=O)C
|
|
571
|
c1ccc(cc1)c2nnn(n2)Cn3ccc(n3)C(=O)[O-]
|
|
572
|
c1cc(oc1)C(=O)n2cnc(n2)N
|
|
573
|
Cc1nc(nn1c2[n-]cnn2)C(=O)[O-]
|
|
574
|
CC(C)(C)C1=CC=Nn2cnnc2S1
|
|
575
|
CCOC(=O)c1nccnn1
|
|
576
|
c1cc(cc(c1)N)CC(=O)[O-]
|
|
577
|
Cc1cc(nc(n1)C)n2cnc(n2)C#N
|
|
578
|
c1cc(ccc1C[C@@H]2C(=NC(=NC2=O)O)O)F
|
|
579
|
COc1ccc(cc1)C(=O)Oc2cc(n(n2)S(=O)(=O)C)N
|
|
580
|
c1ccc(cc1)n2c(c(nn2)c3nc4ccccc4s3)N
|
|
581
|
Cn1c(cc2c1nc(nc2OC)N)C(=O)[O-]
|
|
582
|
c1cc(ccc1CC(=O)Nc2[n-]nnn2)Cl
|
|
583
|
Cc1c(=O)n2c(csc2nn1)c3ccccc3
|
|
584
|
c1cc(oc1)c2nnn(n2)CC(=O)[O-]
|
|
585
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
586
|
c1cc(=O)n(nc1[O-])c2[n-]nnn2
|
|
587
|
Cc1[nH]nc(n1)c2nc([nH]n2)C
|
|
588
|
CCC1NN2C(=O)NC(NC2S1)SC
|
|
589
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
590
|
CN1C=NS(=O)(=O)c2c1nccc2
|
|
591
|
C[C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)c2nc3c(cccn3n2)N)O)O)O
|
|
592
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
593
|
|
|
594
|
c1ccc(cc1)n2cnc3c2cncn3
|
|
595
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
596
|
COC(CNC1=Nc2c(cccn2)OC1)OC
|
|
597
|
Cc1c(c([nH]n1)n2cccc2)C(=O)[O-]
|
|
598
|
CNC(=O)N[C@@H]1[C@H]([C@@H]([C@@H](O1)CO)O)O
|
|
599
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
600
|
c1cncc(c1Sc2nnns2)S(=O)(=O)N
|
|
601
|
Cn1c(nc(n1)n2c3ccccc3nn2)N
|
|
602
|
c1cc(oc1)c2c(nns2)C(=O)N
|
|
603
|
Cc1nnc(o1)[C@@H]2Cc3ccccc3CN2
|
|
604
|
Cc1c(nnc(c1c2[n-]nnn2)[O-])C
|
|
605
|
c1cocc1c2ncc(c(n2)NCCO)F
|
|
606
|
Cc1cc(nc(n1)Nc2c(nn[nH]2)C(=O)C)C
|
|
607
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
608
|
c1ccc2c(c1)nc(s2)NC3=N/C(=CC(=O)[O-])/C(=N3)[O-]
|
|
609
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
610
|
Cc1c(c(on1)C)C/C(=N/c2[nH]ncn2)/[O-]
|
|
611
|
C1COCCN1c2[n-]nnn2
|
|
612
|
c1cc2c(c(c1)S(=O)(=O)CCC(=O)[O-])non2
|
|
613
|
C1CCC(CC1)N2CNc3nnnn3C2
|
|
614
|
Cn1c(ccn1)c2nnc(o2)N
|
|
615
|
Cc1c(cn(n1)c2ccccn2)N3C[C@@H](CC3=O)C(=O)[O-]
|
|
616
|
Cc1nnc(o1)[C@H]2CCN(C2)C(=O)C
|
|
617
|
C1[C@@H]2N(C1=O)[C@@H](/C(=C/CO)/O2)C(=O)[O-]
|
|
618
|
c1c(c(nc(=O)n1N2CCCCC2)[O-])C#N
|
|
619
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
620
|
c1c2c(cc3c1OCO3)nn[nH]2
|
|
621
|
Cc1nc(cs1)C/C(=N/c2[nH]ncn2)/[O-]
|
|
622
|
Cc1cc(=O)n([nH]1)c2cc(nc(n2)c3ccccc3O)C
|
|
623
|
c1ccc(cc1)SC/C(=N/c2[nH]ncn2)/[O-]
|
|
624
|
c1ccc(cc1)N2C[C@@H](CC2=O)c3nnc(o3)N
|
|
625
|
Cc1nc(nc(n1)N)c2ccccc2
|
|
626
|
COc1cc(ncn1)N2CCNC(=O)C2
|
|
627
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
628
|
C1CNNCC1CCC(=O)[O-]
|
|
629
|
|
|
630
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc2cc(no2)C)[O-]
|
|
631
|
c1cc(oc1)c2nc(on2)CO
|
|
632
|
Cc1c(c(on1)c2c(nns2)C)C(=O)[O-]
|
|
633
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
634
|
c1ccnc(c1)CCS(=O)(=O)[O-]
|
|
635
|
Cn1c(ncn1)c2csc(n2)c3ccncc3
|
|
636
|
Cc1cc2nc(nc(n2n1)N)N
|
|
637
|
COC(=O)c1cc(=O)nc(s1)N
|
|
638
|
Cc1c2c(c(nn1)[O-])n[nH]n2
|
|
639
|
c1ccc(cc1)Oc2nc3ccc(nn3c(=O)n2)Cl
|
|
640
|
CN1CC(CN1)NC(=O)CCN2CCOC2=O
|
|
641
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
642
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
643
|
c1[nH]c(c(n1)C(=O)[O-])C(=O)[O-]
|
|
644
|
c1ccc2c(c1)n(c(=O)o2)CCn3cnc(n3)C#N
|
|
645
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
646
|
CCCc1[nH]c2cnn(c2n1)[C@@H](C)CCC
|
|
647
|
C1CC(=CC[C@@H]1CC(=O)[O-])c2nc(on2)C3CC3
|
|
648
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
649
|
Cc1cc(=O)n2c(n1)sc(n2)Sc3ncnn3N
|
|
650
|
c1cnn(c1)c2cncc(n2)Cl
|
|
651
|
CN1CC(CN1)NS(=O)(=O)C2CCCS2
|
|
652
|
COC(=O)c1c(ccs1)Oc2ncccn2
|
|
653
|
C[C@@H]1C(=NC(=NC1=O)c2ccccc2)C(=O)[O-]
|
|
654
|
c1ccc(cc1)S(=O)(=O)CC2=Nc3cccn3C2=O
|
|
655
|
COc1cccc(c1)[C@@H]2N=C(C(=O)O2)Cc3ccco3
|
|
656
|
CCOC(=O)C1=C(O[C@@H](C1)C2CCCCC2)N
|
|
657
|
c1ccc2c(c1)C(=O)OC2(n3cnnn3)n4cnnn4
|
|
658
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
659
|
c1ccc(cc1)CSc2[n-]nnn2
|
|
660
|
c1ccc(cc1)[C@@H]2C3=C(CCCC3)[NH+]=C4N2NN=N4
|
|
661
|
Cnccs/c1=NC(=O)c2ccc[nH]2
|
|
662
|
CCOC(=O)/C=C(C)/Nc1c[nH]nc1
|
|
663
|
c1ccn2c(c1)n/c(=NC(=O)c3ccco3)/s2
|
|
664
|
c1ccc(cc1)CCC(=O)n2cnnc2N
|
|
665
|
c1c2n(nc1C(=O)[O-])CCOC2
|
|
666
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
667
|
c1nc(nn1Cc2nc(nc(n2)N)N)C#N
|
|
668
|
CC1(Cc2cccc(c2O1)Oc3ccc(cn3)C#N)C
|
|
669
|
C=CCN(Cc1ccc2c(c1)non2)Cc3ccco3
|
|
670
|
Cc1c2c([nH]c(=O)n(c2=O)Nc3ccc(cc3)O)sn1
|
|
671
|
c1c([nH]c(=O)[nH]c1=O)c2[n-]nnn2
|
|
672
|
Cc1c(non1)OCCn2c(nnn2)N
|
|
673
|
c1ccc(cc1)OCCc2nnc(o2)N
|
|
674
|
CCCn1c2=N[C@@H](C(=c2c(=O)[nH]c1=O)[O-])C
|
|
675
|
CC1NC(ON1)[C@@H]2CCC=CC2
|
|
676
|
c1cc(oc1)Cn2cnc(=O)[nH]c2=O
|
|
677
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
678
|
Cc1c(c[nH]n1)S(=O)(=O)[O-]
|
|
679
|
c1cn2cc(nc2cn1)c3c(non3)N
|
|
680
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
681
|
c1cc(oc1)c2nnc(o2)c3c(non3)N
|
|
682
|
Cc1cc(nc(n1)[O-])C(=O)N
|
|
683
|
CC(C)(C)OC(=O)N[C@@H](CS(=O)(=O)[O-])C(=O)[O-]
|
|
684
|
c1c(n(nn1)c2cncc(n2)Cl)CO
|
|
685
|
c1ccn(c1)c2ccc(cc2)SCC(=O)[O-]
|
|
686
|
C1CC(OC1)C2NC(=O)[NH]C(=O)S2
|
|
687
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
688
|
C=CCNS(=O)(=O)c1nc[nH]n1
|
|
689
|
c1c([nH]cn1)c2nc(cs2)C(=O)[O-]
|
|
690
|
C1C2C(NNNC2[O-])N(N1)[C@@H]3CCCO3
|
|
691
|
c1c(nc[nH]1)C2(CCCC2)O
|
|
692
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
693
|
|
|
694
|
Cc1cc2c(n[nH]c(=O)c2c(=O)[nH]1)Cc3ccco3
|
|
695
|
Cc1ccc(cc1)S(=O)(=O)/N=C(/Nc2nccs2)[O-]
|
|
696
|
Cn1cc(nc1)S(=O)(=O)Oc2ccsc2C(=O)OC
|
|
697
|
Cc1c(c(sn1)C(=O)[O-])N
|
|
698
|
c1(n[nH]c(=O)o1)c2nnc(o2)[O-]
|
|
699
|
Cc1c(nc(o1)c2ccoc2)CN3CCC[C@H]3C(=O)OC
|
|
700
|
CCn1c2c(c(n1)C)NC(=O)CNC2=O
|
|
701
|
Cc1c(nnc(c1C#N)NCc2ccoc2)C
|
|
702
|
CN1C2C(C(=O)[NH]1)NCCN2
|
|
703
|
c1cc2c(nc1)NCCC(=O)N2
|
|
704
|
CC1=CC=CN2C1=[NH+]C(=C3C2=NC(=O)C[C@@H]3c4ccc(cc4)F)[O-]
|
|
705
|
c1ccc2c(c1)nc(s2)SCn3c4ccccc4oc3=O
|
|
706
|
C1CCC2C(C1)-C3C(CCCN3)S2(=O)=O
|
|
707
|
c1ccc(cc1)c2cnc3c(n2)non3
|
|
708
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
709
|
Cc1cc(=O)n2c(n1)SCCC2
|
|
710
|
CC1C(C(=O)NC([NH]1)N)N2C(=O)C3CCCCC3NN2
|
|
711
|
C1=N[C@@H]2[C@@H](C(=O)N1)N=CN2[C@@H]3[C@@H]([C@@H]([C@@H](O3)CO)O)O
|
|
712
|
Cc1nc(sn1)C2=CCCN(C2)C
|
|
713
|
C[C@@H](C#N)NC(=O)N[C@@H](C)C(=O)N
|
|
714
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
715
|
c1ccc(cc1)c2c3c(c(nn2)[O-])nc[nH]3
|
|
716
|
c1csc(n1)n2cnnn2
|
|
717
|
CCC/C=C/C2=C([C@@H]([C@@H](CC2)O)O)C(=O)O1
|
|
718
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
719
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
720
|
Cn1c2c(cn1)c(ncn2)Sc3nnc(o3)c4cccnc4
|
|
721
|
COC(=O)N1CCc2c(c(ns2)[O-])C1
|
|
722
|
c1cc(ccc1c2c(n[nH]n2)Nc3c(non3)N)Cl
|
|
723
|
|
|
724
|
c1ccc(cc1)S(=O)(=O)Nn2cnnc2
|
|
725
|
CNc1nc(nc(n1)n2cnc(n2)SC)NC
|
|
726
|
c1ccc(cc1)CN2CCNS2(=O)=O
|
|
727
|
Cc1c(nn(n1)c2ccccc2)c3nnc(o3)[O-]
|
|
728
|
Cc1cc(ccc1/N=C/Cc2cccs2)OCC(=O)[O-]
|
|
729
|
c1cc(sc1)c2[nH]c(nn2)N
|
|
730
|
CSc1c(c(sn1)SC)c2[n-]nnn2
|
|
731
|
CC(C)(C(=O)[O-])n1cnnn1
|
|
732
|
C1C(C([NH]N1)C(=O)N)[C@@H]2[C@@H](CCO2)O
|
|
733
|
CS(=O)(=O)NCc1ccccn1
|
|
734
|
C/C=C/c1nnnn1[C@H]2CO[C@H]3[C@@H]2OC[C@H]3O
|
|
735
|
Cc1nc(no1)CSc2nncs2
|
|
736
|
CCCOCC(=O)/N=c/1[nH]c(n[nH]1)c2ccccn2
|
|
737
|
|
|
738
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
739
|
Cc1cc(cs1)Oc2c[nH]c(=O)nc2
|
|
740
|
Cc1c2c(oc(c2c(=O)[nH]n1)NC(=O)Cn3ccnc3)C
|
|
741
|
Cc1c(cn(n1)C(=O)C)c2nc(sn2)Nc3ccccc3
|
|
742
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
743
|
CN(Cc1ccc(s1)Cl)Cn2cc(nn2)C(=O)OC
|
|
744
|
CC1NC([NH]N1)SCCN2CCCN2
|
|
745
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
746
|
Cc1c(cc2c(n1)nc(o2)[O-])c3ccncc3
|
|
747
|
CC(=O)N[C@@H]1[C@@H]([C@@H]([C@@H](O[C@@H]1OC)CO)O)O
|
|
748
|
c1ccc2c(c1)nc(s2)Sc3c(non3)N
|
|
749
|
CCC/N=c/1c(c(c1=N/CCC)O)O
|
|
750
|
c1ncn(n1)Cn2cncn2
|
|
751
|
c1cc2c(cc1C3=CNC(=O)CO3)cc([nH]2)c4ccncc4
|
|
752
|
c1ccc(cc1)c2nccn2c3ccnc(n3)Nc4ccccn4
|
|
753
|
Cc1nc2c(s1)c(nnc2[O-])c3ccco3
|
|
754
|
CC(C)(C)Nc1[n-]c(c(n1)C#N)C#N
|
|
755
|
Cc1c(non1)NCn2cnnn2
|
|
756
|
CN1c2ccccc2Oc3ccc(cc3S1(=O)=O)C(=O)[O-]
|
|
757
|
Cc1nc([nH]n1)SCc2c(snn2)Cl
|
|
758
|
CCOC(=O)c1c2c(c(s1)C)c(nnn2)[O-]
|
|
759
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
760
|
Cc1c(n[nH]c(=O)c1C#N)/C=C/c2cccs2
|
|
761
|
Cc1ncc(s1)CN(C)[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
762
|
c1ccc(cc1)c2nnn(n2)Cn3c(=O)c4ccccc4nn3
|
|
763
|
c1ccc(cc1)c2c(cno2)c3nnnn3c4ccccc4
|
|
764
|
CCc1nnc(o1)COC(=O)cc([n-]s/c2=NC)C
|
|
765
|
Cn1cc(c2c1[nH]ccc2=O)c3ccnc(n3)N
|
|
766
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
767
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
768
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
769
|
Cc1nnc(o1)CSc2ccccn2
|
|
770
|
c1cc(sc1)C(=O)n2cccn2
|
|
771
|
c1cnc(c2c1n3c(ccn3)nn2)[O-]
|
|
772
|
C/C(=N/c1nc(nn1C(=O)N)N)/O
|
|
773
|
c1cc(oc1C(=O)n2cnnc2N)Br
|
|
774
|
Cn1c(nnn1)Sc2nccc(n2)OC
|
|
775
|
Cc1nc(no1)Cc2[nH]c3ccccc3n2
|
|
776
|
CC(=O)NC1CCCN2C1NNN2
|
|
777
|
COc1nc(nc(n1)OC)Nc2nccs2
|
|
778
|
CC(=O)Nc1nnc(s1)Cc2[nH]c3ccccc3n2
|
|
779
|
CC(=O)OC1C2C(C(NN1)[O-])SCCS2
|
|
780
|
Cc1c(c(n[nH]1)C)SCC(=O)[O-]
|
|
781
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
782
|
c1c(c2ncnc(n2n1)[O-])C#N
|
|
783
|
CCn1c(nn(c1=O)C)C(=O)[O-]
|
|
784
|
c1ccc(c(c1)C2=NCCN=C(C2)C(=O)[O-])O
|
|
785
|
c1cc(nc(c1)F)n2c(c(cn2)n3cncn3)O
|
|
786
|
CC(C)(C)OC(=O)Nc1c[nH]nc1
|
|
787
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
788
|
COc1cnc(nn1)c2cnc(nn2)OC
|
|
789
|
Cn1c(=O)c(nn(c1=O)c2ccc(cc2F)F)c3ccn[nH]3
|
|
790
|
CCNC(=O)[C@@H](C)n1cnnc1C#N
|
|
791
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
792
|
CC1(COC2CC(CC3C2N1NN3)N)C
|
|
793
|
c1cn(cn1)OCCCCC(=O)[O-]
|
|
794
|
c1cc(oc1)C(=O)n2ccc(n2)c3cccs3
|
|
795
|
CC(C)(C)OC(=O)NCCn1c(c(nn1)C#N)N
|
|
796
|
Cc1cc(no1)CSc2nc(c(o2)C)C
|
|
797
|
CC1=C[C@@H]2c3c(non3)C=CC2=N1
|
|
798
|
c1ccc2c(c1)N=C(CN2C(=O)NCC(=O)[O-])O
|
|
799
|
c1ccc(cc1)S(=O)(=O)n2ccnc2
|
|
800
|
Cc1c(=O)n2c(nn1)SCC(=O)N2
|
|
801
|
c1ccc(cc1)c2nnnn2SCC(=O)c3ccccc3
|
|
802
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
803
|
c1nc([nH]n1)SCCCN2CCOC2=O
|
|
804
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
805
|
c1nc2n(n1)C(=O)CC(=N2)[O-]
|
|
806
|
Cc1c(cno1)c2cn3ccccc3n2
|
|
807
|
CC1=C[C@@H](c2c(=O)[nH]c(=O)[nH]c2O1)c3ccccc3
|
|
808
|
Cc1cc(n(n1)c2ncccn2)C
|
|
809
|
CCS(=O)(=O)N1CCC[C@@H](C1)/C(=N/C2[NH]NCN2)/[O-]
|
|
810
|
C1C(SC(N1)N)[C@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
811
|
C[C@@H]1c2nc(nn2[C@](C(=O)O1)(C)CC#C)[C@@H](C)O
|
|
812
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
813
|
CCOC(=O)c1[nH]nc(n1)N
|
|
814
|
c1csc(n1)C(=O)CC#N
|
|
815
|
C1CC2C(CC1C3NNC(O3)N)SCN2
|
|
816
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
817
|
CNC(=O)c1c2c(c(=O)oc1N)nns2
|
|
818
|
c1ccc2c(c1)nn(n2)Cc3ccco3
|
|
819
|
CC1CC2CC3N(C2NN1)N=CCC3
|
|
820
|
c1[nH]c2c(n1)c(nnc2N)N
|
|
821
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
822
|
c1ccc2c(c1)c(=O)n(nn2)Cn3cnc(n3)C#N
|
|
823
|
c1cc(nnc1n2cnnn2)Cl
|
|
824
|
c1cc(ccc1C(=O)c2nnc(s2)Cl)Cl
|
|
825
|
Cn1c(=O)c(nn(c1=O)C)Oc2ccc3c(c2)OCO3
|
|
826
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
827
|
C1CCN(CC1)C2NC(=O)C(NS2)N
|
|
828
|
Cc1c(non1)c2[n-]nnn2
|
|
829
|
c1coc2c1C(=O)[C@@H]3CCC(=O)N3C2
|
|
830
|
|
|
831
|
c1ccc2c(c1)ncc(n2)Oc3cnns3
|
|
832
|
C1CCC2C(C1)[NH]C(=NC(=O)CN3CNNN3)[NH]2
|
|
833
|
c1nc(c2n1CC(=O)NC2)C(=O)N
|
|
834
|
CSc1c(=O)nc(sn1)Nc2ccccc2
|
|
835
|
C[C@@H](C(=O)C1=N[C@@H]2C(=[NH+]C1)NC(=NC2=O)[NH-])[O-]
|
|
836
|
Cc1ccc(cc1)S(=O)(=O)[N-]c2cc([nH]n2)C
|
|
837
|
COc1c(nccn1)N2CCC(CC2)NS(=O)(=O)C
|
|
838
|
CC(=O)NC1=N[C@@]2([C@@H](c3ccccc3[C@@]2(N1)O)O)O
|
|
839
|
C1CCC2C(C1)C3C([NH]2)NCNN3
|
|
840
|
Cc1nnn(n1)Cc2nnnn2C
|
|
841
|
CC1NC(ON1)C2CCC3C(C2)SCN3
|
|
842
|
c1(nnc(s1)C(=O)N)C(=O)N
|
|
843
|
c1cc2c(nc1)[C@H](C(=O)O2)C#N
|
|
844
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
845
|
c1csc(n1)n2cc(c(=O)[nH]c2=O)C#N
|
|
846
|
CN(C/C(=N/c1[nH]ncn1)/[O-])S(=O)(=O)c2ccccc2
|
|
847
|
c1ccnc(c1)CC(=O)c2ccco2
|
|
848
|
c1ccc(cc1)CN2C=N[C@@H]3[C@@H]2N=C(N=C3N)Cl
|
|
849
|
COC(=O)NS(=O)(=O)C1CCCO1
|
|
850
|
Cc1ccc(cc1)S(=O)(=O)/N=c/cc([nH]c(=O)[nH]2)[O-]
|
|
851
|
c1ccc(cc1)OCC(=O)Nc2[n-]nnn2
|
|
852
|
C/C(=Nc1ccccc1)/c2c([nH]c(=O)[nH]c2=O)[O-]
|
|
853
|
C1Cc2c(n[nH]c2C(=O)[O-])C1
|
|
854
|
COc1nc(nc(n1)OC)C(=O)c2ccccc2
|
|
855
|
c1ccn(c1)c2ccc(nc2)Oc3cc(cnc3)Cl
|
|
856
|
c1cscc1c2c[nH]cc2C(=O)[O-]
|
|
857
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
858
|
c1ccc(cc1)c2nc(sn2)c3ccc(nn3)Cl
|
|
859
|
c1cc(oc1)c2ccc(=O)[nH]n2
|
|
860
|
c1ccc(c(c1)OCc2c[nH]cn2)Cl
|
|
861
|
CCn1c2ccccc2nc(c1=O)[C@H]3c4ccccc4NC3=O
|
|
862
|
CCc1nnc(c2n1c(nn2)c3ccc(cc3)F)[O-]
|
|
863
|
c1c2c(nc(n1)N)SCC2
|
|
864
|
CCNC(=O)Oc1c2ccccc2on1
|
|
865
|
CC1NC(C(NN1)C(=O)N)[O-]
|
|
866
|
c1c(sc(n1)Cl)CSc2[nH]ncn2
|
|
867
|
CC(C)(C)OC(=O)N[C@H](Cc1ccn[nH]1)C(=O)[O-]
|
|
868
|
COC(=O)Cc1cccnn1
|
|
869
|
CC(=O)c1c-2n(n(c1=O)c3ccccc3)C(=O)c4c2nccn4
|
|
870
|
Cc1ccc(cc1)S(=O)(=O)Cn2cnnn2
|
|
871
|
c1ccc2c(c1)nnn2Cc3[n-]nnn3
|
|
872
|
CCS(=O)(=O)N1CCC[C@@H](C1)C(=O)Oc2cccnc2
|
|
873
|
Cc1c(non1)NCNc2c(non2)C
|
|
874
|
c1ccc(cc1)NC(=O)[C@@H]2CC(=Nc3n2cnn3)O
|
|
875
|
c1(nc(nc(n1)N)N)C(=O)[O-]
|
|
876
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
877
|
c1nc([nH]n1)/N=C(/[C@@H]2CCCO2)[O-]
|
|
878
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
879
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
880
|
CCC1=C(OS(=O)(=O)NC1=O)C2CCCCC2
|
|
881
|
c1ccc2c(c1)c(=O)n(nn2)CSc3nnc(o3)C4CC4
|
|
882
|
C1NC([NH]N1)NC2=NCCO2
|
|
883
|
C[C@@H]1CN(C[C@@H](O1)C)S(=O)(=O)CCNc2ccccn2
|
|
884
|
C1CC(=O)O[C@@H]1c2nc(c(o2)N)C#N
|
|
885
|
CNc1nnc(s1)c2cnccn2
|
|
886
|
CC1(Cc2c([nH]c3c2c(ncn3)N)CO1)C
|
|
887
|
CC1C2C(NCN1)S[C@@H](CC2)O
|
|
888
|
Cc1c2cc(cnc2on1)S(=O)(=O)[N-]c3cccnc3
|
|
889
|
CC1C(C(N[NH]1)C2CCON2)N
|
|
890
|
c1cc(nn2c1ncc(c2=O)N)N3CCCC3
|
|
891
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
892
|
C[C@@H](c1cccnc1)C(=O)[O-]
|
|
893
|
CC1=Nc2c(cccn2)NC(=O)C1
|
|
894
|
Cc1cc(nc(n1)Nc2cc(on2)C)C#N
|
|
895
|
Cc1nn2cc(nc2s1)NC(=O)OC
|
|
896
|
Cc1ccc(cc1)NC(=O)[C@@H]2CC(=O)n3cnnc3N2
|
|
897
|
C[C@@H]1C2=C(COC2=O)NC(=O)N1
|
|
898
|
CCC(=O)Oc1c(c(c([nH]1)C)C(=O)C)C
|
|
899
|
COc1ncc(c2n1nc(n2)S(=O)(=O)[O-])F
|
|
900
|
Cn1cnc(c1C#N)n2oo2
|
|
901
|
|
|
902
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
903
|
c1cc2c(c(c1)O)nnn2[O-]
|
|
904
|
Cc1nc(no1)c2ncon2
|
|
905
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
906
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
907
|
c1nc(c2c(ncn2n1)C#N)[O-]
|
|
908
|
Cc1nc(cs1)Cn2c(=O)oc(n2)c3ccc(cc3)F
|
|
909
|
CCOC(=O)c1c([nH]c(=O)s1)c2ccco2
|
|
910
|
c1cn(cn1)c2nc(nc(n2)Cl)N3CCCCC3
|
|
911
|
c1ncn(n1)C(=O)NC2CCCCC2
|
|
912
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
913
|
c1ccc(cc1)CCn2cnnn2
|
|
914
|
c1cc(oc1)c2cc(=O)n3cnnc3s2
|
|
915
|
C/C=C/[C@@H]1[C@@H]([C@@H](C2=C(O1)[C@@](OC2=O)(C)O)O)O
|
|
916
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
917
|
c1ccnc(c1)N[C@@H]2C[C@@H]3[C@H](O2)[C@@H](CO3)O
|
|
918
|
c1ccc(cc1)c2cc(on2)Cn3cnc(n3)C#N
|
|
919
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
920
|
Cc1csc(n1)Sc2nc(ns2)Cl
|
|
921
|
Cc1ccc2c(c1)c(=O)c(co2)c3nnc(s3)N
|
|
922
|
Cc1cc(=O)n2c(n1)SCC(=O)N2
|
|
923
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
924
|
Cc1c(non1)CC(=O)Nc2ccccc2
|
|
925
|
Cc1c(c(no1)/C=C/c2ccc(cc2)F)N
|
|
926
|
C[C@@H]1c2nnc(n2N[C@@H](O1)c3ccccc3Cl)[C@@H](C)O
|
|
927
|
Cc1nc(cs1)c2cc(no2)CO
|
|
928
|
COc1ccc(cc1)n2c(=O)c(c3c(n2)NC(=O)C3)C#N
|
|
929
|
CC1C(C(ON1)C)CCC2NNC(O2)N
|
|
930
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)[O-]
|
|
931
|
CCCCNC(=O)C1=C(NSN1)c2ccccc2O
|
|
932
|
C([C@@H]1[C@@H]([C@@H]([C@@H](O1)O)O)O)O
|
|
933
|
c1cnn(c1)c2nnn(n2)CC(=O)[O-]
|
|
934
|
CCOC1CCCC2N1CNN2
|
|
935
|
c1cc(oc1)/C=c/2c(=O)n3cnnc3s2
|
|
936
|
CC(=O)NCCc1coc2c1ccnc2
|
|
937
|
c1cc(cc(c1)N)c2cocn2
|
|
938
|
c1cnc2cc3c(cc2n1)[C@@H]4C[C@H]3C(=O)NC4
|
|
939
|
c1ccc(cc1)C#CCNc2[n-]nnn2
|
|
940
|
Cc1c(nn2cc(nc2n1)CCNS(=O)(=O)C)C
|
|
941
|
CN(C)C1=[NH+]C=CC(=CC1)c2ccccc2
|
|
942
|
CCOC1CNNN1C2CCN(CC2)C(=O)OCC
|
|
943
|
CC(=O)N[C@@H](CS/N=N/c1ccccc1)C(=O)[O-]
|
|
944
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
945
|
CCCNC(=O)Cc1nc[nH]n1
|
|
946
|
c1nc(nn1CC(=O)N)C#N
|
|
947
|
Cc1c(c[nH]n1)C(=O)N2CCn3c(nc(n3)C)C2
|
|
948
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
949
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
950
|
c1c([nH]nn1)SCC(=O)N
|
|
951
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
952
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
953
|
CSc1c(c([nH]n1)c2ccco2)C#N
|
|
954
|
c1ccnc(c1)CN2c3c(nc[nH]3)C(=O)N4C2=NCC4
|
|
955
|
COCCn1c(=O)c2c(nn1)scn2
|
|
956
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
957
|
CC(C)c1nnc(o1)C(=O)[O-]
|
|
958
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
959
|
c1cc(oc1)c2nnc(o2)[O-]
|
|
960
|
c1ccc(cc1)[C@@]2(c3cnncc3C(=O)N2)O
|
|
961
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
962
|
Cc1nnc(n1N)Sc2nccc(n2)OC
|
|
963
|
Cc1csc(n1)SCc2nnc(o2)C
|
|
964
|
Cn1c(ccn1)CNC(=O)Cn2cccnc2=O
|
|
965
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
966
|
Cn1c(cc(=O)n(c1=O)C)Cn2nc(nn2)c3ccccc3
|
|
967
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
968
|
Cn1c(nnn1)Sc2cccc(c2C#N)F
|
|
969
|
Cc1csc(n1)c2cn[nH]c2N
|
|
970
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
971
|
C=CCNC(=O)[C@@H]1c2c(nc3ccccc3n2)NC1=O
|
|
972
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
973
|
CCOc1c(c([nH]n1)N)C#N
|
|
974
|
Cc1cc2cccc(c2o1)n3cnnn3
|
|
975
|
c1cnccc1n2cc(cn2)N
|
|
976
|
CC1=Nn2c(nnc2SC1)Cn3c4ccccc4nn3
|
|
977
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
978
|
Cc1nc(c2c(n1)oc(n2)C)n3cc(c(=O)[nH]c3=O)F
|
|
979
|
c1ccc-2c(c1)Cn3c2nnn3
|
|
980
|
Cc1c(=O)n2c(nn1)SCC(=N2)N
|
|
981
|
C1Cc2c(nn(c2N)CCC#N)C1
|
|
982
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
983
|
c1c2c(nc(n1)N)CCOC2
|
|
984
|
c1ccc(cc1)NCc2cc[nH]n2
|
|
985
|
c1cc2c(c(c1N)N)non2
|
|
986
|
c1ccc(cc1)c2noc(=O)n2Cc3nc4ccccc4o3
|
|
987
|
c1csc2c1ncnc2N
|
|
988
|
COc1ccc(cc1)/C=C/C(=O)N=C(S2)CC(=O)C3CC3
|
|
989
|
c1nc2c(c(n1)N)N=C[C@H]2[C@@H]3[C@@H]([C@H]([C@@H](O3)CO)O)O
|
|
990
|
c1ccc(cc1)c2c3c(nccn3)n[nH]2
|
|
991
|
C1Cc2c3c(nnc4c3c(nn2)CCC4)C1
|
|
992
|
COC(=O)c1c([nH]c(c1C(=O)OC)c2ccsc2)C#N
|
|
993
|
Cc1cnc(nc1c2ncnn2C)N
|
|
994
|
CCNC(=O)Cn1ccnc1
|
|
995
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
996
|
c1cc(sc1)C(=O)/N=c/2[n-][nH]nn2
|
|
997
|
CC1C(NNN1/C=C/C2CCCCC2)C(=O)[O-]
|
|
998
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
999
|
c1ccc(cc1)C(=O)[C@@]2([C@@H](c3ccccc3O2)O)Cn4cncn4
|
|
1000
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
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