(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
|
2
|
COc1cccc(c1)C2=CCN(C(=O)N2)c3ccccc3O
|
|
|
3
|
|
|
|
4
|
CCc1c(ccc(n1)C)OCc2[nH]c3cnccc3[nH+]2
|
|
|
5
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
6
|
c1ccc(cc1)[C@@H]2[C@@H]3C(=NC(=O)N2)NC(=O)N3
|
|
|
7
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
|
8
|
c1cc2c(cc1C3=CNC(=O)CO3)cc([nH]2)c4ccncc4
|
|
|
9
|
c1ccc2c(c1)[nH]c(n2)c3c(n(nn3)c4cccc(c4)F)N
|
|
|
10
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
|
11
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
|
12
|
Cc1ccc(cc1)N2Cc3cc(=O)n4c5ccccc5nc4c3=C2N
|
|
|
13
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
|
14
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
|
15
|
CCCNC(=O)NC1=NC(=C([C@H]1C)C(=O)OCC)C
|
|
|
16
|
c1ccc(cc1)COC(=O)N2CCC[C@H]2Cc3[n-]nnn3
|
|
|
17
|
|
|
|
18
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
19
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
|
20
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
|
21
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
|
22
|
C1CCC(CC1)/C=C/C=C/C2C(=O)[NH]C(=O)[NH]N2
|
|
|
23
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
|
24
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
|
25
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
|
26
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
|
27
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
|
28
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
|
29
|
Cncc([nH]/c1=NC(=O)Nc2ccc(cc2)O)[O-]
|
|
|
30
|
Cc1nc(cs1)c2cc([nH]c2)C(=O)n3c(c(cn3)C#N)N
|
|
|
31
|
CCNc1nc2c(s1)c(c(c(n2)N)C#N)c3ccccc3
|
|
|
32
|
C1CCC2C(C1)[C@@](C(=O)N2)(NC3C(NC(C(N3)C#N)C#N)N)O
|
|
|
33
|
C1CN(C(=O)[NH]C1=O)/C=C/[C@@H]([C@@H](CO)O)O
|
|
|
34
|
c1cc(ccc1NC2=CC(=O)N=[NH+]2)F
|
|
|
35
|
Cc1cc([nH]n1)NC(=O)c2cccc(c2)Cl
|
|
|
36
|
Cc1ccc(cc1)S/C=C/c3ccccc3C(=O)N2
|
|
|
37
|
Cc1ccc2c(c1)[nH]/c(=Nc3nc(cc(n3)O)C)/o2
|
|
|
38
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
39
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
|
40
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
|
41
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
|
42
|
c1cc(ccc1C#N)c2ccc(o2)/C=C/C(=O)N=C(N3)[O-]
|
|
|
43
|
CCSc1nnc(s1)NC(=O)c2ccc3c(c2)nc[nH]3
|
|
|
44
|
CCOC(=O)C1=C(CN(C1)Cc2ccccc2)c3ccccc3
|
|
|
45
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
|
46
|
CC(=O)Nc1ccc(cc1)C2=NC3=Cc4ccccc4O[C@@H]3O2
|
|
|
47
|
[H]/N=C/1N[C@H](N/C(=N/c2ccc(cc2)Cl)/N1)c3ccc(cc3)OC
|
|
|
48
|
c1cc(oc1/C=C/C(=O)NC(=O)N2)N3CCOCC3
|
|
|
49
|
c1ccc2c(c1)CCN2c3c(=O)[nH]c(=O)[nH]n3
|
|
|
50
|
c1ccc2c(c1)[nH]c(n2)c3c(c4cccnc4s3)[O-]
|
|
|
51
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
|
52
|
c1ccc2c(c1)ncn2/C=C/NC(=O)c3ccc(cc3)Cl
|
|
|
53
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
54
|
CCOC(=O)c1c(c2c(s1)cc(oc2=O)c3cccnc3)N
|
|
|
55
|
c1ccc(c(c1)N)Nc2ccc3c(c2)CCc4c(cccn4)C3=O
|
|
|
56
|
c1ccc2c(c1)c(n[nH]c2=O)CSc3ccccn3
|
|
|
57
|
c1cnccc1C2c3c(c(n[nH]c3=O)[O-])Nc4c2c(=O)[nH]nc4[O-]
|
|
|
58
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
|
59
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
|
60
|
C1CCC(CC1)C2NC(=O)[NH]C(=O)S2
|
|
|
61
|
Cn1c(=O)[nH]c(=O)n2c1ncc2CC(=O)Nc3ccccc3
|
|
|
62
|
Cc1ccc(cc1)Nc2cc(cs2)[C@@]3(CCC(=O)O3)C
|
|
|
63
|
|
|
|
64
|
c1cc(cc(c1)N)c2c3c(c4n2CCC4)c(=O)[nH]nc3[O-]
|
|
|
65
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
66
|
CCNC(=O)Nc1nc2cc(ccn2n1)c3cccnc3
|
|
|
67
|
c1ccc2c(c1)c(=O)c(c(s2)N)c3[nH]c4ccccc4n3
|
|
|
68
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
69
|
CS(=O)(=O)NCCNC1CNCCN1
|
|
|
70
|
c1ccc(cc1)[C@@H]2C=CNC(=N2)Nc3nc4ccccc4o3
|
|
|
71
|
c1ccc(cc1)NC(=O)/C=c/2c(nc3n2c4ccccc4n3)O
|
|
|
72
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
|
73
|
c1[nH]c(=O)c2c(n1)Oc3c(c(=O)[nH]cn3)C2
|
|
|
74
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3cccs3
|
|
|
75
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
76
|
c1ccc2c(c1)c(cs2)Nc3cccnc3
|
|
|
77
|
C/C(=C/C(=NC(=NC1=O)O)O)/Nc2cccc(c2)C(F)(F)F
|
|
|
78
|
c1ccc2c(c1)[nH]c(n2)Sc3c(non3)N
|
|
|
79
|
|
|
|
80
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
|
81
|
Cc1ccc(o1)[C@@H]2Nc3ccccc3C(=[NH+]2)O
|
|
|
82
|
c1cnc(c(n1)C#N)NCc2nc3c(s2)CCCC3
|
|
|
83
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
|
84
|
COC1=CC2CCNC3C2C(C4CCCCC4C3[O-])C1=O
|
|
|
85
|
CN(C)C(=O)n1c(nnn1)Cc2ccc(cc2)c3ccccc3
|
|
|
86
|
CCO[C@@H](C)C(=O)/N=c/1[nH]c(n[nH]1)c2ccc(s2)C
|
|
|
87
|
C1CCC(CC1)N2C(=O)N3N(C2=O)-C4CC5CCCCC5CC4C3
|
|
|
88
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
|
89
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
|
90
|
c1ccc2c(c1)cc(c(=O)o2)C3=Nc4ccccc4S(=O)(=O)N3
|
|
|
91
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
92
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
93
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
94
|
Cc1ccc(cc1)NC(=O)[C@@H]2CC(=O)n3cnnc3N2
|
|
|
95
|
c1cc2n(c1)CCN(C2)/C(=N/c3[nH]nc(n3)c4ccco4)/[O-]
|
|
|
96
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
|
97
|
c1ccnc(c1)COC2=C(C(=O)O[C@@H]2[C@@H](CO)O)[O-]
|
|
|
98
|
c1ccc(cc1)C(=O)OC[C@@H]2COC(=O)N2
|
|
|
99
|
c1cc(ccc1OC(=O)NCn2ccnc2)Cl
|
|
|
100
|
c1[nH]c(nn1)/N=C(/C=C(/C(F)(F)F)Nc2[nH]ncn2)[O-]
|
|
|
101
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
|
102
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
|
103
|
C[C@@H]1CCCC[C@@H]1NC(=O)COc2cnc(nc2)c3ccccc3
|
|
|
104
|
c1ccc(cc1)n2c(nnn2)Sc3nnc4n3cccc4
|
|
|
105
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
|
106
|
c1ccc(cc1)n2c(c(nn2)c3nc4ccccc4s3)N
|
|
|
107
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
|
108
|
C1CCC(CC1)N2C3C(CN2)[NH]C(=O)[NH]3
|
|
|
109
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
110
|
COc1ccc(cc1OC)/C=C/c2nc(on2)c3ccccc3O
|
|
|
111
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
|
112
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
|
113
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
|
114
|
|
|
|
115
|
[H]/N=c/n(cc(o1)c2ccc(cc2)CC)c3nc(cc(n3)C)C
|
|
|
116
|
c1ccc2c(c1)[nH]c(n2)c3ccc[nH]3
|
|
|
117
|
c1ccc(cc1)C2=C(NNC(=[NH2+])N2)c3ccccc3
|
|
|
118
|
C1COCCN1c2c(n[nH]n2)C(=O)N
|
|
|
119
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
|
120
|
C=C1/C(=CNC2CCCCC2)/C(=O)N([NH]1)C3CCCCC3
|
|
|
121
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
|
122
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(cnn3)N2)c4ccco4
|
|
|
123
|
Cc1nnc(o1)NCc2nc(cs2)c3ccc(cc3)F
|
|
|
124
|
c1ccc(cc1)c2c([n+]3c4ccccc4sc3s2)O
|
|
|
125
|
Cc1cc(on1)Cc2nc(no2)c3cccc4c3cc[nH]4
|
|
|
126
|
c1ccc(cc1)C(=O)NCSc2ccncn2
|
|
|
127
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
|
128
|
|
|
|
129
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
|
130
|
Cc1ccc(cc1)SC(=O)N/C=C/c2ccsc2
|
|
|
131
|
CC1C2C(ON1)C[C@@H](CC(=N2)C)C3CCCCC3O
|
|
|
132
|
c1ccc(cc1)c2cc([nH]c(=O)n2)c3ccccc3O
|
|
|
133
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)o2
|
|
|
134
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
135
|
c1cc(oc1)/C=C/CNc2ccc(c(c2)Cl)F
|
|
|
136
|
c1ccc(cc1)[C@@H]2C[C@@H](n3c(nnn3)N2)c4ccccc4
|
|
|
137
|
COc1ccc(cc1)C2=COc3ccccc3C(=O)N2
|
|
|
138
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
|
139
|
Cc1nc([nH]n1)CNC(=O)Nc2[nH]nc(n2)Cc3ccccc3
|
|
|
140
|
c1ccc(cc1)NC(=O)N[C@@H]2[C@@H](N=NS2)C(=O)[O-]
|
|
|
141
|
Cc1c2cnnc(n2cn1)Nc3cccnc3
|
|
|
142
|
CCNc1nnc(s1)Cn2c(cc(n2)C)C
|
|
|
143
|
C/C=C/C#CC#C[C@H]([C@H](/C=C/CCCO)O)O
|
|
|
144
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
|
145
|
Cc1cc(=O)oc2c1c(=O)[nH]nc2c3ccccc3
|
|
|
146
|
CC1(/C(=C(Nc2ccccn2)/O)/C(=O)c3ccccc3S1)C
|
|
|
147
|
c1cnccc1c2csc(n2)c3cnc[nH]3
|
|
|
148
|
COC(=O)c1ccc(cc1)NC(=O)/C=c/2[nH]s[nH]c(=C)n2N
|
|
|
149
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
150
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
|
151
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
|
152
|
COC(=O)c1cc(coc1=[NH2+])C(=O)c2cc(ccc2O)Cl
|
|
|
153
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
|
154
|
Cc1c(sc2c1c(=O)[nH]nn2)C
|
|
|
155
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
|
156
|
Cc1c(sc(=O)n1NC(=O)Cc2ccccc2)c3ccccc3
|
|
|
157
|
C1C2N3C(CC(NC3SC2)N)NC1=O
|
|
|
158
|
c1ccc(cc1)[C@@H]2NC(=[NH2+])Nc3n2c4ccccc4n3
|
|
|
159
|
c1cc2c(cc1F)c(=O)n(cn2)Cc3[nH]ncn3
|
|
|
160
|
c1csc(n1)NS(=O)(=O)c2c(=O)[nH]c(=O)[nH]n2
|
|
|
161
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
|
162
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
|
163
|
c1ccc2c(c1)-c3c[nH]c4c3c(ccc4)C2=O
|
|
|
164
|
Cc1c(n(c(=O)n1c2ccccc2)C)NC(=O)NC3CCCC3
|
|
|
165
|
CC1=C[C@@H](c2c1nc3ccccc3n2)c4cnc5ccccc5n4
|
|
|
166
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
|
167
|
C1CNCC2C1NC(C(C2)C3=CCCCC3)N
|
|
|
168
|
Cc1cc2n(c(=O)c1C#N)CC(=C2)c3ccccc3
|
|
|
169
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
|
170
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
|
171
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
172
|
CCn1c2cc(=O)[nH]c(c2c(n1)N)[O-]
|
|
|
173
|
c1ccn(c1)c2c(c3c(s2)CN(CC3)c4cccc(n4)F)C#N
|
|
|
174
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
|
175
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
|
176
|
C1C2N(C(=O)[NH]C1=O)CCC3=C2CCCC3
|
|
|
177
|
c1ccc(cc1)n2c(=O)c(c(cn2)n3cc(nn3)CO)Cl
|
|
|
178
|
c1ccc(cc1)/C=C/C=C/c2cc[nH]n2
|
|
|
179
|
C1CCc2nn3c(n2CC1)c(c(nc3=O)SCC(=O)N)C#N
|
|
|
180
|
c1cc(oc1)c2cnnn2c3ccc(cc3)N
|
|
|
181
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
|
182
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
|
183
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
|
184
|
COc1ccc(cc1)c2cc-3n(n2)C(=O)c4c3cccc4
|
|
|
185
|
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C
|
|
|
186
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
|
187
|
CCOC(=O)C/C(=N/c1cccc(c1)C(F)(F)F)/N
|
|
|
188
|
Cc1c(nc2n1-c3ccccc3C2)c4ccc(cc4)OC
|
|
|
189
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
|
190
|
[H]/N=C/N/C(=C/CCNC(=O)c3c2cc[nH]3)/C(=N1)[O-]
|
|
|
191
|
c1ccc(cc1)C2=N/C(=Cc3ccc4c(c3)OCO4)/C(=N2)O
|
|
|
192
|
c1ccc2c(c1)-n3c(n[nH]c3=O)CS2
|
|
|
193
|
CC1CC([NH]/C(=NC(=O)CC2C(CCCC2CL)F)/C1)C
|
|
|
194
|
c1ccc(c(c1)C2=N/C(=Cc3ccco3)/C(=N2)O)Br
|
|
|
195
|
Cc1ccc(cc1C)Oc2cc(nc(n2)SC)n3cncn3
|
|
|
196
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
197
|
CCOC(=O)N1CCc2cc(=O)[nH]nc2CC1
|
|
|
198
|
C1CCC(CC1)NC2=NC(=O)C(=NC2=O)NC3CCCCC3
|
|
|
199
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
200
|
C1CCC(CC1)C2C(C3N(N2)-C4CCCCC4[C@@H]3CO)O
|
|
|
201
|
c1ccc2c(c1)c(=O)c(co2)/C=C/c3[nH]c4ccccc4n3
|
|
|
202
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
|
203
|
CCOC(=O)/C=C/1CCC=C1N2CCOCC2
|
|
|
204
|
c1ccc2cc(ccc2c1)NC(=O)Sc3[n-]cnn3
|
|
|
205
|
c1ccc2c(c1)CCN2CCCc3nnc4n3CCCCC4
|
|
|
206
|
c1cc(ccc1n2c(c(nn2)c3nnc4n3CCCCC4)N)Cl
|
|
|
207
|
C[C@@H](n1ccnc1)OCc2ccc(cc2)F
|
|
|
208
|
Cc1nc(cs1)c2c[nH]c(=O)[nH]c2=O
|
|
|
209
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
|
210
|
C1C(=O)CC2NN[NH]N2C1N
|
|
|
211
|
Cc1c2c(c(nn1)[O-])nc([nH]2)c3ccccc3
|
|
|
212
|
|
|
|
213
|
c1ccc2c(c1)c3c([nH]2)C[C@@H]4[C@@H](C3)c5ccccc5NC4=O
|
|
|
214
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
|
215
|
COCC(=O)N1CCC[C@@H](C1)c2c3c([nH]n2)nccn3
|
|
|
216
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
|
217
|
c1ccc(c(c1)N)NCCCn2ccnc2
|
|
|
218
|
COCCCNC(=O)c1c(=O)c2ccccc2sc1N
|
|
|
219
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
|
220
|
CC1(C=C(NC(=O)N1)/C=C/c2ccccc2)C
|
|
|
221
|
Cc1nc(on1)[C@@H](C)Nc2ccc(nc2)OC
|
|
|
222
|
COc1cc(cc(c1OC)OC)c2cc(=O)[nH]c(=O)[nH]c2=O
|
|
|
223
|
c1ccnc(c1)c2ccc(s2)NC(=O)N3CCOCC3
|
|
|
224
|
c1cocc1c2c3c([nH]cn3)nc(n2)N
|
|
|
225
|
c1ccc(cc1)c2c3c(sn2)[C@@H](CC(=N3)O)c4ccccc4
|
|
|
226
|
CCOC(=O)Cc1coc(n1)NC(=O)CSc2ccccn2
|
|
|
227
|
C1CCC(CC1)NC(=O)NC2=CC=CN=CO2
|
|
|
228
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
|
229
|
CCOC(=O)N1CCc2c(nc([nH]c2=O)N)C1
|
|
|
230
|
Cc1ccc(cc1)c2nc(on2)c3cc4ccccc4[nH]3
|
|
|
231
|
c1cc(ccc1c2c(c3cc(c(nc3o2)Cl)C#N)N)F
|
|
|
232
|
c1ccc(cc1)c2nnc(o2)c3cc4ccccc4oc3=O
|
|
|
233
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
|
234
|
c1cn[nH]c1[C@@H]2CCCN(C2)S(=O)(=O)N3CCCCCC3
|
|
|
235
|
Cc1nc(on1)NC(=O)C[C@@H]2CCC=C2
|
|
|
236
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
|
237
|
c1ccc(cc1)c2nc(on2)c3c(c4ccccc4s3)O
|
|
|
238
|
Cc1cn2c(nnc2s1)c3cccnc3
|
|
|
239
|
C1CCC(CC1)C2=N[C@@H]2COC(=O)C3CCC(CC3)BR
|
|
|
240
|
Cc1c(sc(n1)C)c2cc3ccccc3[nH]2
|
|
|
241
|
Cc1cc(c(=O)[nH]n1)Cc2cccs2
|
|
|
242
|
COc1ccccc1NC(=O)c2c(cc(s2)C(=O)OC)[O-]
|
|
|
243
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
|
244
|
c1ccc2c(c1)-c3c(nc(=O)[nH]c(=O)n3)C2=O
|
|
|
245
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
|
246
|
c1ccc2c(c1)[nH]c(n2)C/C=N/c3nccs3
|
|
|
247
|
c1ccc2c(c1)cc([nH]2)c3nnco3
|
|
|
248
|
c1cc2nnc(n2cc1C(F)(F)F)c3nccs3
|
|
|
249
|
Cc1ccc(cc1)[C@@H](COC2=NCNc3c2ccc(c3)Cl)O
|
|
|
250
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
|
251
|
|
|
|
252
|
c1ccc(cc1)/C=C/2NC(=O)C(=O)O2
|
|
|
253
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
254
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
|
255
|
|
|
|
256
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
|
257
|
c1ccc(cc1)Nc2c3cn[nH]c3ncn2
|
|
|
258
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
|
259
|
|
|
|
260
|
c1ccc2c(c1)[nH]c(n2)Nc3nc(nc(n3)[O-])CC#N
|
|
|
261
|
c1ccc(c(c1)N)Nc2c(cn(c(=O)n2)Cc3cccs3)C#N
|
|
|
262
|
CCS(=O)(=O)c1ccc(s1)c2cccc(c2)c3cc[nH]n3
|
|
|
263
|
Cc1ccc(cc1)c2c(c(=O)c2=O)NCCOC
|
|
|
264
|
c1cc(ccc1C(F)(F)F)Nc2c3ccncc3on2
|
|
|
265
|
c1ccc(cc1)NC(=O)N/C=C/c2cccs2
|
|
|
266
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
267
|
c1cnc([nH]1)SCc2c[nH]c(=O)[nH]c2=O
|
|
|
268
|
CCOc1ccc2c(c1)cc(c3n2c(=O)n(n3)C)C4OCCO4
|
|
|
269
|
c1cc(ccc1[C@@H]2CCN3C(=[NH+]2)N=NN3)Br
|
|
|
270
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
|
271
|
CCc1nnnn1Cc2nc(nc(n2)N(C)C)N
|
|
|
272
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
|
273
|
Cc1ccccc1NC2=NC(=[NH+]C(N2)(C)C)N
|
|
|
274
|
CCCCN1CC(=O)N=C1Nc2ccccc2
|
|
|
275
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
|
276
|
Cc1cccc(n1)C#CCSc2ccccc2
|
|
|
277
|
c1ccnc(c1)n[nH]/c2=NC(=O)COCC3CC3
|
|
|
278
|
c1ccc2c(c1)NC3(S2)NC(=O)C(=O)C(=O)N3
|
|
|
279
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
|
280
|
c1ccc(cc1)CCNC(=O)Cc2[n-]nnn2
|
|
|
281
|
CCc1cc2c(cnc(c2o1)OC)C(=O)Nc3c(cncn3)C#N
|
|
|
282
|
c1cc(oc1)c2nnn(n2)Cc3nnnn3C4CC4
|
|
|
283
|
C1CC[C@H](NCC1)N/C=C/C2=CCCCC2
|
|
|
284
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
|
285
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
286
|
|
|
|
287
|
Cc1nc2c(s1)-c3c(cnc(n3)Nc4ccc(nc4)OC)CC2
|
|
|
288
|
CC1NNC(O1)NC(=O)C2CCC(CC2)C#N
|
|
|
289
|
c1cn(c(=O)nc1N)[C@@H]2CO[C@@H](O2)CO
|
|
|
290
|
c1ccnc(c1)Cc2ccc(=O)[nH]n2
|
|
|
291
|
C[C@@H]1CCC2C(C3C(=O)[NH]C(=O)[NH]C3OC2=O)C1
|
|
|
292
|
Cc1ccc(o1)[C@@H]2C[C@@H](n3c(ccn3)N2)C(F)(F)F
|
|
|
293
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
|
294
|
c1cc(c(cc1c2cn(nn2)C3CCCCC3)Cl)Cl
|
|
|
295
|
CCc1n[nH]c(=O)n1CCOc2ccccc2
|
|
|
296
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
|
297
|
c1ccc2c(c1)C[C@@]3(c4ccccc4C=C3NC2=O)O
|
|
|
298
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
|
299
|
CN1c2ccccc2C3(C1=O)[NH+]=c4ccccc4=[NH+]3
|
|
|
300
|
c1ccc(cc1)C(=O)Nc2cnc3n(c2=O)ncs3
|
|
|
301
|
c1ccc2c(c1)nnn2CC#C[C@@H](c3ccco3)O
|
|
|
302
|
CCc1c2c(n(n1)C3CCCC3)C(=O)N(CC2)c4ccccc4
|
|
|
303
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
|
304
|
c1ccc2c(c1)C(=O)N[C@@H](N2)c3ccco3
|
|
|
305
|
Cc1ccc2c(c1)oc(n2)c3ccc(cc3)O
|
|
|
306
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
|
307
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
|
308
|
CC(=O)N1CC2CC3C(C4C2C1CCC4)C[C@@H](CN3C)OC(=O)C
|
|
|
309
|
Cc1ccc(cc1)c2nnc(o2)c3c(cnc(n3)SC)Cl
|
|
|
310
|
Cc1nc([nH]n1)c2c[nH]nc2N
|
|
|
311
|
c1ccc2c(c1)cc(c(=O)o2)C3=CSC(=C4C=CC(=O)C=C4)[N-]3
|
|
|
312
|
CCOC(=O)Cn1nc(nn1)CSc2ccc(cc2)Cl
|
|
|
313
|
Cc1c(cc2c(c(sc2n1)c3nnc(o3)C)N)C(=O)C
|
|
|
314
|
CS(=O)(=O)NCCOc1cc(ncn1)N2CCCC2
|
|
|
315
|
C1CCc2c([nH]/c(=NC(=O)CCC(=O)[O-])/s2)C1
|
|
|
316
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
|
317
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
|
318
|
Cc1cc(nc2c1nc(o2)OCc3ccc(cc3)Cl)C
|
|
|
319
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
|
320
|
CCn1c2ccccc2n3c1nnc3c4cc(nn4C)C
|
|
|
321
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
|
322
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
|
323
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
|
324
|
c1ccc2c(c1)cc(o2)C(=O)/C=C/c4ccccc4N=CN3
|
|
|
325
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
|
326
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
|
327
|
Cc1cc(n(n1)C(=O)c2c(nc(s2)Nc3ccccc3)C)C
|
|
|
328
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
|
329
|
Cc1cc(cc([o+]1)C)/C=C/c2ccccc2
|
|
|
330
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
|
331
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=NC(=N2)N3CCOCC3)[O-]
|
|
|
332
|
COC(=O)c1cc2c(s1)c(n[nH]2)N
|
|
|
333
|
c1nc2c(s1)c(=O)[nH][nH]c2=O
|
|
|
334
|
c1ccc2c(c1)-c3cccn3[C@@H](N2)c4ccc5c(c4)CCO5
|
|
|
335
|
Cn1cc(ccc1=O)c2nnc(o2)c3cc4c(s3)CCC4
|
|
|
336
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
|
337
|
CCOc1cnc(o1)c2c(onc2c3ccccc3Cl)C
|
|
|
338
|
CCOC(=O)c1c(snn1)Sc2[nH]c(cn2)C
|
|
|
339
|
Cc1c(c(on1)N)c2nc(cs2)c3ccc(cc3)OC
|
|
|
340
|
Cc1c(non1)CC(=O)NCC[C@@H]2C[C@H]3C[C@@H]2C=C3
|
|
|
341
|
Cc1ccc(c(n1)N)Cn2c(c(sc2=O)CCO)C
|
|
|
342
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
|
343
|
Cc1ccsc1C(=O)N[C@@H]2CCc3c(cnc(n3)C)C2
|
|
|
344
|
C1CC2C(C(C1)N[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O)[NH]CNC2=O
|
|
|
345
|
CCNc1nnc(s1)Sc2ccc3nnnn3n2
|
|
|
346
|
COC(=O)c1c(cc(s1)c2cc(no2)c3ccccc3)N
|
|
|
347
|
c1cc2c3c(c(=O)[nH]c2nc1)C=NCCO3
|
|
|
348
|
C1CN(NC1C(=O)N)[C@@H]2[C@H]([C@@H]([C@@H](O2)CO)O)O
|
|
|
349
|
c1ccc(cc1)/C=C/C#Cc2ccccc2
|
|
|
350
|
Cc1ccc(cc1)c2ncc(o2)Sc3ccccc3
|
|
|
351
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
|
352
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
353
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
|
354
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccco3
|
|
|
355
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
|
356
|
c1ccc(cc1)N2Cc3ccccc3C2
|
|
|
357
|
c1cc2c(cc1F)cc(c(=O)o2)c3csnn3
|
|
|
358
|
c1ccc(cc1)n2c(nnn2)Cn3cnc(n3)C#N
|
|
|
359
|
c1csc(c1C#N)n2cc(c(=O)[nH]c2=O)C#N
|
|
|
360
|
c1ccc2c(c1)c(ns2)SCn3c4ccccc4nn3
|
|
|
361
|
c1cc2c(c[nH]c2nc1)C3=CCCCC3
|
|
|
362
|
Cc1cc(c(=O)[nH]n1)Cc2ccco2
|
|
|
363
|
CCN1C=C2[C@@H](CN=C2c3c1cc(cc3)c4ccncc4)O
|
|
|
364
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
|
365
|
CCc1cc2c(s1)S[C@@H](NC2=O)c3ccccc3
|
|
|
366
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
|
367
|
Cc1ccc(cc1)N2Cc3ccccc3C=C2N
|
|
|
368
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
|
369
|
c1csc2c1c(ncn2)n3c(c(cn3)C#N)N
|
|
|
370
|
c1ccc2c(c1)[C@H]3C[C@@H]([C@@H]2N3)c4ccc(nc4)Cl
|
|
|
371
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
|
372
|
Cc1c(oc(n1)SCc2nc(nc(n2)N)N)C
|
|
|
373
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
|
374
|
c1ccc(cc1)Nc2nc(nc(n2)N)Cc3cc(n[nH]3)O
|
|
|
375
|
Cc1cc(no1)C(=O)Nc2cccc(c2)c3[n-]nnn3
|
|
|
376
|
COC(=O)c1c2c3c(nsc3s1)SCC(=N2)O
|
|
|
377
|
c1ccc2c(c1)C(=O)N[C@@H](O2)c3ccco3
|
|
|
378
|
Cc1ccn(n1)CCc2nc(no2)Cc3ccsc3
|
|
|
379
|
c1cn(cn1)c2cc(=O)[nH]c(n2)N
|
|
|
380
|
COC1CC2C3C(C1)SCC(=O)N3NN2
|
|
|
381
|
c1ccc2c(c1)c(=O)c(c([nH]2)[O-])C(=O)Nc3nccs3
|
|
|
382
|
Cc1nc2c(n1C)CCN(C2)C[C@@H](c3ccc(cc3)OC)O
|
|
|
383
|
c1ccc-2c(c1)CN[C@@H](c3n2ccc3)c4ccc(cc4)F
|
|
|
384
|
|
|
|
385
|
C1CCC(CC1)CSN2CC-3C4CCCCC4NC3NC2
|
|
|
386
|
c1csc(n1)SCc2nc(nc(n2)N)N
|
|
|
387
|
Cc1ccccc1n2cc[nH]c(=O)c2=O
|
|
|
388
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
389
|
c1ccc(cc1)NC(=O)Nc2csc(n2)c3ccncc3
|
|
|
390
|
COC(=O)CN1CNC(N1)C2[NH]C(=O)C3C(N2)CCS3
|
|
|
391
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
|
392
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
393
|
c1cc(cnc1)[C@H]2[NH+]=c3c(=[N+]2[O-])cccn3
|
|
|
394
|
c1ccc(cc1)CNc2cnccn2
|
|
|
395
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
|
396
|
Cc1cc(nc(n1)OC)Oc2ccc(nn2)[O-]
|
|
|
397
|
c1ccc2c(c1)c(ns2)NCc3cccs3
|
|
|
398
|
c1ccc2c(c1)ccc(n2)C3=CNc4ccccc4C3
|
|
|
399
|
c1ccc2c(c1)/C(=N/c3[nH]c4ccccc4n3)/NC2=O
|
|
|
400
|
c1cnc(cn1)c2c(nco2)C(=O)[O-]
|
|
|
401
|
CCOc1ccc(cc1)NCC2=CCNC=C2
|
|
|
402
|
c1ccc2c(c1)N3CN(CN=C3N2CO)Cc4ccc(cc4)Cl
|
|
|
403
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
|
404
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
|
405
|
Cc1nc(cs1)/C=C/c2cccnc2
|
|
|
406
|
CC1C(N(C(C1C#C)C)C)/C=C/C(=C/C(=O)OC)/C
|
|
|
407
|
Cc1cccc(c1)NC2=CC(=O)[C@H]([NH+]=N2)c3ccccc3
|
|
|
408
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
|
409
|
CC1=N[C@@H](C(=N[C@@H](C1)c2ccc(cc2)Cl)C#N)C#N
|
|
|
410
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
|
411
|
c1ccc2c(c1)CC[NH+]=C(N2)N3CCOCC3
|
|
|
412
|
c1ccc2c(c1)nc(c3n2cnn3)Nc4cc(ccc4O)Cl
|
|
|
413
|
c1cc(cnc1)c2cc([nH]n2)NC(=O)c3cnns3
|
|
|
414
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
|
415
|
CCNc1c(cc(c2c1nccc2)Cc3cnc(nc3N)N)C
|
|
|
416
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
|
417
|
c1ccc2c(c1)C[C@@H]3C(=O)N=C(N3C2)Nc4ccccc4F
|
|
|
418
|
Cc1csc(=O)n1CCC(=O)[C@@H](C#N)c2ccccn2
|
|
|
419
|
C1CCC2C(C1)NC3N2C(NS3)N4CCNC4
|
|
|
420
|
CC1(c2c([nH]c(=O)s2)Sc3c1sc(n3)[O-])C
|
|
|
421
|
c1ccc(cc1)n2c(cnn2)Cn3cnc4ccccc4c3=O
|
|
|
422
|
CCOC(=O)CCc1cn2cc(nc(c2n1)OC)Br
|
|
|
423
|
c1ccc(cc1)n2cc(nc2)NC(=O)n3ccccc3=O
|
|
|
424
|
Cc1c(nc(nn1)N)/C=C/c2cc(cc3c2cccc3)O
|
|
|
425
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
|
426
|
C[C@]12CN(C[C@H]1NC(=O)c3ccccc3C2=O)C(=O)C4CC4
|
|
|
427
|
c1ccc(cc1)CNc2c(non2)O
|
|
|
428
|
c1ccc(cc1)c2cn(c(=O)o2)c3ccccc3
|
|
|
429
|
c1ccc2c(c1)nnn2/C=C/c3ccc[nH]3
|
|
|
430
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
|
431
|
Cc1c(n(c(c1c2[nH]c3ccccc3n2)N)C4CCCC4)C
|
|
|
432
|
c1cc(cnc1)Cc2c3[nH]c4c(c(=O)n3[nH]c2=O)CCC4
|
|
|
433
|
c1ccc(cc1)/C=C/c2cc(cc(=O)o2)[O-]
|
|
|
434
|
CCOC(=O)Cc1nnc2n1c3ccccc3[nH]2
|
|
|
435
|
CC(C)Cc1nc(on1)CNc2ccn(n2)CC(=O)N
|
|
|
436
|
Cc1cc(sn1)[C@@H](c2ccc(cc2)C(C)C)Nc3cccnc3
|
|
|
437
|
c1ccc(c(c1)N)Sc2ccc3nncn3n2
|
|
|
438
|
c1cscc1C(=O)c2cn[nH]c2N
|
|
|
439
|
Cn1c2c(cnc(n2)c3cccnc3)c(=O)nc1[O-]
|
|
|
440
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
|
441
|
COC(=O)Cc1nnn(n1)Cc2nnnn2c3ccccc3
|
|
|
442
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
|
443
|
c1ccc2c(c1)nnn2Cc3nc4ccccc4s3
|
|
|
444
|
c1ccc(cc1)SCC(=O)Nc2[n-]nnn2
|
|
|
445
|
Cc1cc(no1)Cn2c3ccccc3nn2
|
|
|
446
|
CC1CC2CC(OC2C3C1C(NNC3CL)CL)C
|
|
|
447
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
|
448
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
|
449
|
c1ccc(cc1)c2nnc(s2)Oc3ccc4ccc(=O)oc4c3
|
|
|
450
|
c1ccc2c(c1)c(=O)c(=N[C@@H]3[C@@H](c4ccccc4C3=O)O)c2=O
|
|
|
451
|
c1cc(cnc1)C#CCCN2CCC(=CC2)c3cccs3
|
|
|
452
|
c1ccc(cc1)NC(=O)C(=N2=CC=CC=C2)C#N
|
|
|
453
|
c1ccc(cc1)CN2Cc3c(=O)c4ccccc4sc3NC2
|
|
|
454
|
|
|
|
455
|
c1ccc(cc1)NC2=CCN3C=CC=CC3=C2
|
|
|
456
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
|
457
|
c1cc(cc(c1)Cl)n2ccc(n2)c3cnccn3
|
|
|
458
|
CCOC(=O)c1c(cc([nH]1)c2ccco2)N
|
|
|
459
|
|
|
|
460
|
c1ccc2c(c1)CC[C@@]3(C2)Nc4ccccc4S3
|
|
|
461
|
Cc1c(sc(n1)CCn2cccc(c2=O)C(F)(F)F)C(=O)C
|
|
|
462
|
c1ccc(cc1)[C@@H]2CC(=Nc3c2c[nH]n3)O
|
|
|
463
|
c1c(c(=O)n2c(n1)SCC2)c3nc(on3)CCCC(=O)[O-]
|
|
|
464
|
COC(=O)c1cc2c(s1)CN(C2)c3ccccc3Cl
|
|
|
465
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
466
|
c1c2c(c(=O)[nH]n1)Sc3cn[nH]c(=O)c3S2
|
|
|
467
|
c1ccc(cc1)CCN2CC3=C(CCCC3=O)NC2
|
|
|
468
|
Cc1c(n2c(c1C(=O)NCc3ccccc3)NC(=O)CC2)C
|
|
|
469
|
CCCCCC(=O)NC1C(N[NH]N1)C#N
|
|
|
470
|
Cc1ccc2c(cc(=O)oc2c1)CSc3[nH]ncn3
|
|
|
471
|
CC(C)CCN1C=N[C@@H]2C1=NC(=NC2=O)N
|
|
|
472
|
CC1(C[C@@H](c2n1ccc2)Nc3ccc(cc3)OC)C
|
|
|
473
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
|
474
|
C[C@@H](Cn1cc(cn1)Cl)c2cc(=O)[nH]c(n2)NC(C)C
|
|
|
475
|
c1ccn(c1)c2c[nH]c(=O)[nH]c2=O
|
|
|
476
|
CCCN(C)c1ccc2c3c(cn2n1)c(nn(c3=O)C)Cl
|
|
|
477
|
Cn1cc(c(n1)C(F)(F)F)COC(=O)Nc2ccccc2
|
|
|
478
|
COC(=O)CCCCc1c2c(cs1)[nH]c(=O)[nH]2
|
|
|
479
|
Cn1c(nnc1SCc2ccccc2)c3ccc(cc3)O
|
|
|
480
|
c1ccc(cc1)NCCn2cccc2
|
|
|
481
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
|
482
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
|
483
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
484
|
COc1nc(cnn1)c2cnnc(n2)OC
|
|
|
485
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
|
486
|
COC(=O)N1CCC(CC1)c2cc(=O)[nH]s2
|
|
|
487
|
Cc1cc2c(nc(nc2o1)C)c3cnoc3
|
|
|
488
|
c1cc(cnc1)Sc2cc3c(cc2O)CCO3
|
|
|
489
|
c1ccc(cc1)Nc2cccc(c2)c3nnsn3
|
|
|
490
|
c1ccc2c(c1)c(c-3c(n2)CSc4c3cc(cc4)Cl)C(=O)[O-]
|
|
|
491
|
c1ccc(cc1)C2=N/C(=C/Nc4ccccc4S3)/C(=O)N2
|
|
|
492
|
c1c(c2nc(=O)[nH]c(=O)n2[nH]1)Br
|
|
|
493
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
|
494
|
c1ccc2c(c1)-c3c(c(=O)[nH]nc3C2=O)C#N
|
|
|
495
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
|
496
|
c1ccc2c(c1)C(=C(CS2)C(=O)Nc3ccccn3)[O-]
|
|
|
497
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
|
498
|
c1c(cn(n1)Cc2nc(nc(n2)N)N)Cl
|
|
|
499
|
c1cc(ccc1C2=NC(=CC2)c3ccncc3)Cl
|
|
|
500
|
c1cc(ccc1c2c(c[nH]n2)N3C=CCCC3=O)Cl
|
|
|
501
|
Cc1cc(nc2c1c3c(s2)c(n[nH]3)c4ccccc4)C
|
|
|
502
|
C=Cn1ccnc1CCOC(=O)c2ccc(cc2)Cl
|
|
|
503
|
c1ccc2c(c1)c(c(s2)NC(=O)O)C#N
|
|
|
504
|
c1cnn(c1)c2cc(=O)[nH]c(n2)N
|
|
|
505
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
|
506
|
Cc1ccc(cc1)S(=O)(=O)Nn2c(c(nn2)c3ccccc3)C
|
|
|
507
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
|
508
|
c1ccc(cc1)n2c(c-3sc4ccccc4nc3c2=O)[O-]
|
|
|
509
|
CCOC(=O)c1cccnc1SNC(=O)Nc2ncccn2
|
|
|
510
|
c1ccc(cc1)c2nc(on2)c3c(n(nn3)c4ccccc4)N
|
|
|
511
|
Cc1nc2cnccc2n1c3ccc(cc3)C4=CC(=O)NCCN4
|
|
|
512
|
CC1=CC(=O)N[C@@H](C1)c2ccccc2
|
|
|
513
|
c1ccc2c(c1)nc(o2)C3=CNc4ccccc4N=C3
|
|
|
514
|
Cc1cc(oc(=O)c1NC(=O)c2cnccn2)c3ccco3
|
|
|
515
|
c1ccc(cc1)Cn2ccc-3c(c(=O)oc3c2)c4ccccc4
|
|
|
516
|
Cc1c(c2ccccc2n1C)c3cc(n[nH]c3=O)c4ccccc4
|
|
|
517
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
|
518
|
c1ccc2c(c1)[nH]c3n2ncn3
|
|
|
519
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
|
520
|
c1ccnc(c1)c2nnc(s2)c3ccc(cc3O)O
|
|
|
521
|
c1cc(ccc1c2ncc(s2)c3ccc(c(n3)[O-])C#N)Cl
|
|
|
522
|
c1ccc(cc1)COc2c(nccn2)N
|
|
|
523
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
|
524
|
|
|
|
525
|
c1ccc(cc1)OCc2nc([nH]n2)N
|
|
|
526
|
C1CCC2C(C1)CC3C(N2)-C4CCCC5C4N(C3)CCC5
|
|
|
527
|
|
|
|
528
|
COc1ccc(cc1)/C=C/c2nc3c(o2)C=CCC3
|
|
|
529
|
|
|
|
530
|
c1ccc-2c(c1)CCc3c2n[nH]c3
|
|
|
531
|
Cc1ccnc(c1)Nc2ccc(nn2)NCCNC(=O)C
|
|
|
532
|
CCC(=O)Oc1c(n[nH]c1N)C
|
|
|
533
|
c1ccc(cc1)C2=C/C(=C/c4ccccc4NC3=O)/C(=O)O2
|
|
|
534
|
Cc1c([nH]c(c1C#N)N)Cc2ccccc2
|
|
|
535
|
Cc1ccc(cc1)C2=CSNC(=N2)c3ccccc3OC
|
|
|
536
|
CCc1nnnn1Cc2ccn(n2)c3cccc(c3)F
|
|
|
537
|
Cc1ccc(cc1)N2C[C@@H]3Cc4ccccc4CN3C2
|
|
|
538
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
|
539
|
CSc1ccc(cc1)c2nc(on2)c3ccc[nH]c3=O
|
|
|
540
|
c1ccc(c(c1)C2=Nc3cncnc3NC2)N
|
|
|
541
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
|
542
|
CN(Cc1ccc(cc1)C#N)Cc2nc(nc(n2)N)N
|
|
|
543
|
COc1ccc(cc1)c2c(c(sn2)C(=O)OC)N
|
|
|
544
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
|
545
|
COCCN1CNC(=NC1)Nc2nc3ccccc3o2
|
|
|
546
|
CCOc1c(o/c(=NC(=O)c2ccccc2)/s1)C(=O)OCC
|
|
|
547
|
COc1ccccc1NC(=O)Cc2[nH]c(=O)[nH]c(=O)[nH+]2
|
|
|
548
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
|
549
|
C1CCC(CC1)CNS(=O)(=O)CC2=N[C@@H]3C=CC=C[C@@H]3N=C2
|
|
|
550
|
c1ccc(cc1)c2cn3c(=O)c4ccccc4sc3c2C#N
|
|
|
551
|
|
|
|
552
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
|
553
|
c1cc(ccc1c2c3c(c(ncn3)N4CCCC4)sn2)F
|
|
|
554
|
Cc1ccccc1[C@@H]2N=C(Nc3n2c4ccccc4c(=O)n3)N
|
|
|
555
|
C1CC(CCC1NC(=O)C2=C([C@@H]3C=C[C@H]2O3)C(=O)[O-])CL
|
|
|
556
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
|
557
|
c1ccc2c(c1)nc(o2)c3nc4ccccc4s3
|
|
|
558
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
|
559
|
c1ccc(cc1)n2c3c(ccc(=O)o3)cn2
|
|
|
560
|
c1ccc2c(c1)CC[C@@H]2Nc3cncc(n3)Cl
|
|
|
561
|
c1cc(ccc1CCc2c[nH]c3c2c(=O)[nH]c(n3)N)C(=O)[O-]
|
|
|
562
|
c1ccc(cc1)[C@@H]2CC(=C(O2)N)c3nc4ccccc4s3
|
|
|
563
|
Cc1ccc(cc1)SCCN(C)Cc2cnc(nc2)OC
|
|
|
564
|
CC1(Cc2c(c(n[nH]2)/C=C/c3ccccc3)C(=O)C1)C
|
|
|
565
|
|
|
|
566
|
c1ccc(c(c1)N)Sc2cnccn2
|
|
|
567
|
c1[nH]c(=O)c2c(n1)c(c3n2CCCC3)C#N
|
|
|
568
|
CC(C)NC(=O)c1ccc(o1)c2cncnc2
|
|
|
569
|