(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
Cn1ccc(n1)Nc2c3cc(ccc3ncn2)Oc4ccccn4
|
|
|
2
|
c1ccc(cc1)Cn2cnc(n2)NC3=Nc4cccc5c4c3ccc5
|
|
|
3
|
c1ccc(cc1)c2nc(on2)c3c(=O)ccn(n3)c4ccccc4
|
|
|
4
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
5
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
|
6
|
c1ccc2c(c1)nc(o2)/C=C/c3csc(n3)c4ccccn4
|
|
|
7
|
COc1ccc(cc1)/N=C/Cc2nc(c(s2)C#N)C(F)(F)F
|
|
|
8
|
C[C@@H](C(=O)c1ccccc1)Sc2nc(on2)c3cccnc3
|
|
|
9
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
10
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
11
|
c1ccnc(c1)SCc2ncn(n2)c3cccc(n3)F
|
|
|
12
|
c1ccc(cc1)Nc2nc(nc3n2ncc3C#N)Nc4cccnc4
|
|
|
13
|
c1cscc1c2cnc(c(n2)N3CCC[C@@H](C3)CCCO)N
|
|
|
14
|
c1ccc(cc1)c2nc(co2)Cn3nc(nn3)c4ccco4
|
|
|
15
|
c1ccc(cc1)c2ncc(o2)COC(=O)n3ccc(=O)[nH]c3=O
|
|
|
16
|
c1ccnc(c1)n[nH]/c2=NC(=O)c3csc(n3)c4ncccn4
|
|
|
17
|
CN1CCNC1CN2CC(CN2)C3CCCC(C3)C4C[NH]NC4
|
|
|
18
|
C1CCC(CC1)[C@@H]2CC/C(=C/3C=CC(=N3)C4CCCCC4)/[NH2+]2
|
|
|
19
|
|
|
|
20
|
c1cc(cnc1)c2ccnn2CN3CCOCC3
|
|
|
21
|
Cc1ccccc1OCC(=O)Nn2c(nnn2)Nc3ccccc3
|
|
|
22
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
|
23
|
c1cnc(nc1)c2nc(cs2)/C=C/c3ccc(cn3)C#N
|
|
|
24
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
25
|
c1cc(cnc1)/C=C/c2c[nH]nc2c3[nH]cc(n3)C(F)(F)F
|
|
|
26
|
Cc1nc(nn1c2ccc(cc2)F)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
27
|
c1ccc(cc1)n2nc3ccc4c(c3n2)nc(cn4)N
|
|
|
28
|
Cc1cc2nc(cc(=O)n2o1)N(C)Cc3ccsc3
|
|
|
29
|
c1ccc(cc1)n2c(n/c(=NC(=O)CCC(=O)[O-])/[nH]2)N
|
|
|
30
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
31
|
Cc1ccc(cc1)c2nn3c4c(nc5c(n4)non5)nc3s2
|
|
|
32
|
c1cc2c(cc1/C=C/c3nnc(o3)c4cnccn4)OCCO2
|
|
|
33
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
|
34
|
c1ccc2c(c1)CN(CCN2)c3cnc4ccccc4n3
|
|
|
35
|
c1ccc(cc1)C(=O)C=c2sc(=CC(=O)c3ccccc3)s2
|
|
|
36
|
C[C@@H](c1ccccc1)Nc2cc3c(cn2)onc3c4ccccc4
|
|
|
37
|
C[C@@H](c1ccnc(n1)N)Oc2ncn(n2)c3ccccc3
|
|
|
38
|
CCn1c(c(c2c1nc3ccccc3n2)c4[nH]c5ccccc5n4)N
|
|
|
39
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
40
|
CNC(=O)c1c([nH]cn1)Nc2nc3ccccc3s2
|
|
|
41
|
Cc1nc(nc(n1)c2ccccc2O)/C=C/c3c[nH]c4c3cccc4
|
|
|
42
|
|
|
|
43
|
Cc1cc(nc(n1)C2=[NH+]c3ncnn3[C@@H](N2)c4ccccc4)C
|
|
|
44
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2Sc4[nH]cnn4
|
|
|
45
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|
|
|
46
|
Cc1cc(=O)n2c(n1)sc(n2)Cn3nc(nn3)c4ccccc4
|
|
|
47
|
Cc1csc(n1)CNc2nc(cnn2)c3ccc(cc3)F
|
|
|
48
|
Cc1ccc(o1)c2cnnc(n2)NCc3cn4c(n3)SCC4
|
|
|
49
|
Cc1c(c2ccccc2n1C)c3cc(n[nH]c3=O)c4ccccc4
|
|
|
50
|
c1ccc(cc1)c2nnc(s2)Oc3ccc4ccc(=O)oc4c3
|
|
|
51
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
52
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
|
53
|
|
|
|
54
|
CC(=O)Nc1cn(c(n1)C(=O)Nc2cn(c(n2)C(=O)[O-])C)C
|
|
|
55
|
Cc1csc(n1)c2c(c(c(s2)SC)c3cc[nH]n3)C
|
|
|
56
|
c1cc(cnc1)C#CCCN2CCC(=CC2)c3cccs3
|
|
|
57
|
c1ccc(cc1)c2c(scn2)Cn3cnc4cnccc4c3=O
|
|
|
58
|
c1ccc(cc1)CCC2=N[C@H](C=C2)C(=O)c3ccc4c(c3)OCO4
|
|
|
59
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3c4c([nH]cn4)ncn3)O
|
|
|
60
|
CSc1c(c(c(s1)c2cc[nH]n2)c3ccco3)C#N
|
|
|
61
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
|
62
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
|
63
|
c1ccc2c(c1)nnn2Cc3nc(no3)c4c(non4)N
|
|
|
64
|
c1ccc(cc1)c2c(=O)cc3n(n2)c(=O)c4ccccc4s3
|
|
|
65
|
COc1ccc(cc1c2cccc(c2)OC3(CCCC3)C(=O)[O-])F
|
|
|
66
|
c1ccc(cc1)C(=O)C2=Nc3ccccc3/C(=Cc4ccccn4)/N2
|
|
|
67
|
c1ccc(cc1)c2ccc(cc2)c3cc(c4c(n3)ocn4)C(=O)[O-]
|
|
|
68
|
C1CCC(CC1)C2=CC[C@@]3(CC=C(N=C3N2)C4CCCCC4)C#N
|
|
|
69
|
c1ccc2c(c1)cc(c(=O)o2)C3=CSC(=C4C=CC(=O)C=C4)[N-]3
|
|
|
70
|
Cc1nc(cs1)c2nnc(o2)SCC(=O)c3ccccc3
|
|
|
71
|
Cc1cc(n(n1)[C@H]2CC(=O)O[C@@H]2COC(=O)c3ccccc3)C
|
|
|
72
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
|
73
|
c1ccc(cc1)[C@@H]2NC(=[NH+]C(=N2)c3ccccc3)c4ccccc4
|
|
|
74
|
CC1CCC2C(C1)NC(C(=O)O2)C3CCCCC3
|
|
|
75
|
C1CCC2C(C1)C(=O)N(O2)C3C4C([NH]CN4)NCN3
|
|
|
76
|
COC(=O)NS(=O)(=O)/C=C/N1C2CCCCC2C3C1CCCC3
|
|
|
77
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
|
78
|
c1ccc2c(c1)c(=O)n(nn2)Cn3c(=O)oc(n3)c4cccs4
|
|
|
79
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1c3ccccc3)c4ccco4
|
|
|
80
|
c1cc(cnc1)Cn2c3c(cn2)c(nc(n3)N)c4ccco4
|
|
|
81
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
|
82
|
Cc1c(=O)nc2n(n1)cnc3n2nc(c3)c4ccccc4
|
|
|
83
|
Cc1ccc(c(c1C)O)c2cc(n[nH]2)C(=O)NCc3ccncc3
|
|
|
84
|
c1cc(oc1)c2c(c(oc2c3ccco3)N)C#N
|
|
|
85
|
Cc1cc(nc2n1nnc2SCC(=O)c3ccc(cc3)F)[O-]
|
|
|
86
|
c1cc(ccc1CCc2c[nH]c3c2nc(nc3[O-])N)C(=O)[O-]
|
|
|
87
|
CC1NNC2N1-C3CCCCC3-C4C(C5CCCCC5[NH]4)C2
|
|
|
88
|
c1ccc2c(c1)[nH]c(n2)[C@H](C#N)c3c(nc(c(n3)C#N)C#N)Cl
|
|
|
89
|
c1cnc(nc1)N2CCC[C@@H](C2)Cn3cc(nn3)CO
|
|
|
90
|
CCOc1ccc(cc1)n2c3c4ccccc4[nH]c3cc(c2=O)N
|
|
|
91
|
c1ccc(cc1)Cn2ccc(n2)n3cnnn3
|
|
|
92
|
Cn1ccnc1CN(C)CCCOc2ccccc2
|
|
|
93
|
CCc1ccc(s1)c2c3c(ncnc3on2)NC
|
|
|
94
|
CC1(Cc2ccccc2-c3c1c(=O)oc(n3)c4ccccc4)C
|
|
|
95
|
Cc1c(nc(o1)c2ccccc2)C(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
96
|
Cc1ccc(cc1)c2nc(no2)COn3c4ccccc4nn3
|
|
|
97
|
COc1ccc(cc1)OCc2nc(ns2)Nc3ccccc3
|
|
|
98
|
CN(Cc1ccco1)Cc2nnnn2C3CC3
|
|
|
99
|
|
|
|
100
|
CSc1nc(sn1)SCSc2[nH]c3ccccc3n2
|
|
|
101
|
c1ccc2c(c1)N3CN(CN=C3N2CO)Cc4ccc(cc4)Cl
|
|
|
102
|
CCCNC(=O)c1c(sc2c1oc(c2)c3ccccc3)C
|
|
|
103
|
c1ccc(cc1)[C@@H](CSc2nc-3n(n2)CNc4c3cccc4)O
|
|
|
104
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
|
105
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
|
106
|
C1COCCN1CCCN2C[C@@]34C[C@@H](O3)CC(=C4C2=O)C(=O)[O-]
|
|
|
107
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
|
108
|
c1ccc2c(c1)nc3c(n2)C4=CC=CC5=CC=C[C@@H]3[C@@H]54
|
|
|
109
|
c1ccc(cc1)C[C@@H](C(=O)[C@@H](C#N)c2ccccn2)n3cnnn3
|
|
|
110
|
c1ccc(cc1)CN2CCc3c(c4cccc5c4n3CC(=O)N5)C2
|
|
|
111
|
c1ccc(cc1)c2cc(c3nnnn3c2)CNc4cccnc4
|
|
|
112
|
Cc1nnc(s1)Sc2cnc3ccccc3n2
|
|
|
113
|
C[C@@H](c1ccc(cn1)F)Nc2cncc(n2)Nc3cc(n[nH]3)OC
|
|
|
114
|
COc1ccccc1N2CCN(CC2)[C@@H]3CCc4c(cc[nH]4)C3=O
|
|
|
115
|
c1ccc2c(c1)OC[C@@H](O2)c3csc4c3c(=O)[nH]cn4
|
|
|
116
|
|
|
|
117
|
C=C1/C(=C/C2=CC3CCCCC3OC2)/C(=O)N([NH]1)C4CCCCC4
|
|
|
118
|
CC1=c2c(=CC(=C3C=CC(=O)C=C3)N1)c4ccccc4oc2=O
|
|
|
119
|
c1ccc(cc1)[C@@H]2c3nnnn3-c4ccccc4C2=O
|
|
|
120
|
CC1(C=C(Oc2ccccc2O1)S(=O)(=O)c3ccccc3)C
|
|
|
121
|
c1cnc([nH]1)Cc2[nH]c(cn2)Cc3cnc[nH]3
|
|
|
122
|
COc1cccc(c1)COc2c3cc4c(nc3on2)CCCC4
|
|
|
123
|
Cc1ccnn1CC/N=c/c(=N/CCCOC)/c(c2O)O
|
|
|
124
|
Cc1c(cc(c(n1)C)C(=O)C)c2ccnc(n2)N3CCCC3
|
|
|
125
|
CCc1nnc(c2n1c(nn2)c3ccc(cc3)F)[O-]
|
|
|
126
|
CC1=NC(=O)C2(N1)CCN(CC2)c3ccnc4c3cn[nH]4
|
|
|
127
|
|
|
|
128
|
CCCN(C)c1ccc2c3c(cn2n1)c(nn(c3=O)C)Cl
|
|
|
129
|
Cc1nc(cs1)c2nc(no2)c3ccc(cc3)CO
|
|
|
130
|
Cc1c(c2c(=O)[nH]cnc2s1)S(=O)(=O)N3CCCCC3
|
|
|
131
|
Cc1cc2nc(cc(=O)n2o1)Sc3cccc(c3)OC
|
|
|
132
|
CSc1nc2n(n1)[C@H](C(=O)N2)CC(=O)Nc3ccccc3
|
|
|
133
|
COc1ccc(cc1OC)[C@@H]2CC[C@@H](O2)Cc3cccnc3
|
|
|
134
|
CC(=O)N1C=Cc2ccccc2[C@@H]1c3c[nH]c4c3cccc4
|
|
|
135
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
|
136
|
c1ccc2c(c1)-c3nc4ccccc4n3[C@H](N2)c5ccco5
|
|
|
137
|
c1cc(cc(c1)F)n2ccc(n2)Cn3cnc(n3)C#N
|
|
|
138
|
C[C@@H]1CC2=C([C@@H](Sc3ccccc3N2)c4ccccc4)C(=O)C1
|
|
|
139
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)n3c(=O)ccc(n3)c4ccco4
|
|
|
140
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
|
141
|
c1ccc2c(c1)nnn2OCc3nnc(o3)c4ccc(cc4)F
|
|
|
142
|
Cc1csc(n1)SCC2=NS(=O)(=O)c3ccccc3N2
|
|
|
143
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3ccoc3
|
|
|
144
|
C1CCC(CC1)C2=CC(=C[C@@](O2)(C3CCCCC3)O)C4CCCCC4
|
|
|
145
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
146
|
c1ccc2c(c1)ccc3c2c4c([nH]3)C5=C(COC=C5)OC4
|
|
|
147
|
CC1C(CC(NN1)C2CCCCC2)N(C)C3CCCCC3
|
|
|
148
|
CC(=O)c1ccc(cc1)Oc2nc(on2)c3ccccc3F
|
|
|
149
|
Cc1ncc(s1)CN(C)Cn2c(=O)oc(n2)c3ccccc3
|
|
|
150
|
Cc1nc2cccc(c2o1)c3cc(n[nH]3)c4cc(ccc4O)Cl
|
|
|
151
|
c1ccc(cc1)CCc2cc(=O)cc([nH]2)c3ccccc3
|
|
|
152
|
Cc1ccc(cc1)C(=O)Nc2cc(c(n(c2=O)N)C)c3cc[nH]n3
|
|
|
153
|
[H]/N=c/n(nc(s1)c2cccs2)CC(=O)c3cccs3
|
|
|
154
|
c1ccc2c(c1)CCN2CC(=O)N3[C@H]4CC[C@@H]3c5c(nns5)C4
|
|
|
155
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
|
156
|
c1cc(ccc1c2ncc3c(n2)-c4ccsc4SC3)C(=O)N
|
|
|
157
|
Cc1ccn(n1)CCNC(=O)c2c(n[nH]n2)c3ccccc3
|
|
|
158
|
Cc1c2cnnc(c2c(n1C)C)Sc3ccc(cc3)Cl
|
|
|
159
|
CCOC(=O)C1=C(CN(C1)Cc2ccccc2)c3ccccc3
|
|
|
160
|
Cc1nnc(s1)Sc2cc(nc(n2)N)Cl
|
|
|
161
|
c1cc2cccc-3c2c(c1)-c4c3sc(c4)CCCC(=O)[O-]
|
|
|
162
|
Cc1ccc(cc1)C2=CSNC(=N2)c3ccccc3OC
|
|
|
163
|
c1ccc(cc1)C2=CC(=N[C@@]2(c3ccccc3)O)c4ccccc4
|
|
|
164
|
c1ccc(cc1)[C@@]2(CCN(C2)Cc3ccnn3[C@@H]4CCCCO4)O
|
|
|
165
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
166
|
c1ccc2c(c1)c(=O)c(c3n2CC(=O)N3)c4[nH]c5ccccc5n4
|
|
|
167
|
CCc1c(nn2c1N/C(=C/3C=C([NH+]=N3)C4CC4)/C=C2O)C
|
|
|
168
|
c1ccc(cc1)OCC2=C(C(=O)O[C@@H]2O)COc3ccccc3
|
|
|
169
|
Cn1ccnc1SCC(=O)C(=C2Nc3ccccc3N2)C#N
|
|
|
170
|
c1ccc(cc1)C2=N/C(=Cc3ccc4c(c3)OCO4)/C(=N2)O
|
|
|
171
|
CCOc1nnc(s1)CN2CCc3ccccc3C2
|
|
|
172
|
Cc1ncc(s1)CN(C)Cc2nnnn2C3CC3
|
|
|
173
|
c1cc(sc1)C2=COC3(C2)CCN(CC3)C(=O)c4cnccn4
|
|
|
174
|
CC(C)(C)c1cc(cc([o+]1)C(C)(C)C)c2cn(c3c2cccc3)C
|
|
|
175
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
|
176
|
COCCn1c(=O)ccc(n1)C(=O)n2c3ccccc3c(n2)N
|
|
|
177
|
Cn1c2c(cn1)[C@@H](CCC2)Nc3c(cccn3)C#N
|
|
|
178
|
CC1(C=C(c2cc(ccc2C1=O)C#N)NC(=O)c3ccccn3)C
|
|
|
179
|
Cc1ccc(cc1C)Sc2c(cccn2)/C(=N/c3[nH]ncn3)/[O-]
|
|
|
180
|
c1ccc(cc1)c2nc(cs2)Cn3c4ccccc4nn3
|
|
|
181
|
Cc1nnc(s1)SCC2=NN(C(=O)C2)c3ccccc3
|
|
|
182
|
c1cnn(c1)c2cncc(n2)N3CCCC3
|
|
|
183
|
c1ccc(cc1)[C@@H]2C=CNC(=N2)Nc3nc4ccccc4o3
|
|
|
184
|
Cc1c(n(c(c1c2[nH]c3ccccc3n2)N)C4CCCC4)C
|
|
|
185
|
Cc1nc(cn1Cc2ccc(cc2)F)c3ccc4ccccc4n3
|
|
|
186
|
Cc1c(nn(c(=O)c1C#N)Cc2nc3ccccc3o2)C
|
|
|
187
|
c1ccc(cc1)c2cc3nnc(c(n3n2)c4ccco4)C#N
|
|
|
188
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3c(noc3C)C
|
|
|
189
|
c1ccc(c(c1)OCc2nc(on2)c3nnc(o3)[O-])Cl
|
|
|
190
|
c1ccn(c1)c2c(c(c(o2)c3cccs3)C#N)c4cccs4
|
|
|
191
|
CCCN(CCC)c1cc(nc2c1nn(c2c3ccccc3)C)C
|
|
|
192
|
c1cc(ccc1c2ccc(o2)/C=C/c3ccc(cn3)C#N)F
|
|
|
193
|
c1ccc(cc1)c2c3c(nc(s3)C#N)n(n2)c4ccccc4
|
|
|
194
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
195
|
c1c(nc2n1CCS2)CNC(=O)[C@@H]3CC(=O)OC34CCCC4
|
|
|
196
|
c1ccc(cc1)n2ncc(n2)Cn3cnc(n3)C#N
|
|
|
197
|
CC1C2C(N(N1)C3CCCCC3)[C@@H](NC2=O)CC4CCCCC4
|
|
|
198
|
Cc1csc(n1)c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
199
|
Cc1nnc(s1)c2cc3ccccc3n2C
|
|
|
200
|
CCOc1nnc(s1)Cn2c(=O)c(c(c(n2)C)C)C#N
|
|
|
201
|
Cc1nc2cnccc2n1c3ccc(cc3)C4=CC(=O)NCCN4
|
|
|
202
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
|
203
|
Cc1[nH]nc(n1)[C@@H](c2ccccc2)NC(=O)C
|
|
|
204
|
Cc1c([o+]c(nc1c2ccccc2)c3ccccc3)/C=CN(C)C
|
|
|
205
|
Cc1ccc(c(c1)C)C(=O)Cc2c(=O)sc3ccccc3n2
|
|
|
206
|
CCS(=O)(=O)c1ccc(c(c1)n2c(c[nH]c2=O)O)OC
|
|
|
207
|
CC1(Nc2ccnn2C(=N1)Oc3ccccc3)C
|
|
|
208
|
c1ccc(cc1)c2cnc(o2)Cn3c(=O)n(nn3)c4ccccc4
|
|
|
209
|
CN(CCc1ccccn1)c2nc(=[N+](C)C)ss2
|
|
|
210
|
CCN(CCc1nc(nc(n1)N)N)c2ccccc2
|
|
|
211
|
Cn1c-2n/c(=NCc3ccccc3)/n(c2c([nH]c1=O)[O-])CC(=O)[O-]
|
|
|
212
|
Cc1c2ccccc2nc-3c1CSc4c3cccc4F
|
|
|
213
|
c1ccc(cc1)c2nnc(o2)OCc3nc4ccccc4s3
|
|
|
214
|
Cc1cc(n(n1)c2nc(nc(n2)OC)n3c(cc(n3)C)C)C
|
|
|
215
|
c1ccc(cc1)c2cc(cc([o+]2)c3ccccc3)c4ccc(cc4)O
|
|
|
216
|
c1ccc(cc1)c2cn-3c([nH+]2)CCc4c3c5c(cccn5)cc4
|
|
|
217
|
COC(=O)c1ccoc1Cn2c(=O)n(nn2)c3ccccc3
|
|
|
218
|
CNC1C(=O)NC(SN1)SC2NC(=O)C(NS2)NC
|
|
|
219
|
CC(C)(C)Cn1c(cc2c1nc(nc2)C#N)COc3ccncc3
|
|
|
220
|
c1ccc2=[NH+]C(=O)C(=c2c1)NNS(=O)(=O)[C@@H]3CC=CC=C3
|
|
|
221
|
c1cc(oc1)c2c(sc(c2c3ccco3)C(=O)N)C#N
|
|
|
222
|
CC(C)(C)OC(=O)NCCc1cn(nn1)Cc2cscn2
|
|
|
223
|
c1ccc(cc1)c2nn3c(nnc3s2)c4cc5ccccc5[nH]4
|
|
|
224
|
CCSc1ccc(c2c1C(=O)CCC2)c3ccccn3
|
|
|
225
|
c1ccc(cc1)[C@@H]2COC(=N2)CC3=N[C@@H](CO3)c4ccccc4
|
|
|
226
|
c1ccc(cc1)C(=O)NCc2nc(on2)Cn3ccnc3
|
|
|
227
|
Cc1ccc(cc1)C(=O)Cc2nnc(s2)C
|
|
|
228
|
c1cc(cnc1)CNc2cc3c(cn2)ncc(c3NC4CC4)C#N
|
|
|
229
|
c1cc(cnc1)c2cc3c([nH]nc3NC(=O)C4CC4)nn2
|
|
|
230
|
Cc1ccc(cc1)c2c(sc(n2)C)Cc3nnc(o3)N
|
|
|
231
|
Cc1cccc(n1)c2nnc(o2)c3csc(n3)N4CCOCC4
|
|
|
232
|
c1ccc(cc1)Oc2nc3cnccn3c(=O)n2
|
|
|
233
|
c1ccnc(c1)NC(=O)Nc2cccc3c2[C@@H]4CCCN4C3=O
|
|
|
234
|
c1cnc(cn1)c2cnoc2C3CCN(CC3)C(=O)C4CC4
|
|
|
235
|
CC1([C@H]([C@@H](c2cc(ccc2C1=O)C#N)Oc3ccccn3)O)C
|
|
|
236
|
c1ccc(cc1)c2nc3n(n2)Cc4ccccc4C35CCOCC5
|
|
|
237
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
|
238
|
Cc1ccc2nc(cn2c1)Cn3nc(nn3)c4ccccc4
|
|
|
239
|
c1cc(c(cc1Cl)C(=O)C2=C/C(=C/3C=CNC(=C3)[O-])/[NH+]=C2)O
|
|
|
240
|
c1cc(ccc1Cn2c(=O)oc(n2)c3ccoc3)C#N
|
|
|
241
|
c1ccc(cc1)C2=N[C@@](C(=O)N2)(C(F)(F)F)Nc3ccccn3
|
|
|
242
|
c1ccc(cc1)NC(=O)CSc2ccc(o2)c3ccncc3
|
|
|
243
|
Cc1c(oc2c1cc(c(c2)OC)/C(=C/C(=N/c3[nH]ncn3)/[O-])/C)C
|
|
|
244
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1c3ccccc3)c4ccccc4
|
|
|
245
|
CNC(=O)n1c(ccn1)c2ccc(o2)c3ccc(cc3F)F
|
|
|
246
|
Cc1c(c(n(n1)c2ccccc2)[O-])/C=C/C=Nc4c3cccc4
|
|
|
247
|
CCn1c(nnc1SC)c2c(=O)ccn(n2)c3ccccc3
|
|
|
248
|
c1ccc(cc1)Cc2c(on(c2=O)C(=O)c3ccccc3)N
|
|
|
249
|
c1cc(cc(c1)C(F)(F)F)C2=CCNc3n2ncc3C(=O)N
|
|
|
250
|
Cc1ccc(cc1)Nc2cc(cs2)[C@@]3(CCC(=O)O3)C
|
|
|
251
|
Cc1cc(c(o1)C)c2cnnc(n2)N3CC[C@@H](C3)COC
|
|
|
252
|
c1cc(c(cc1n2c(=O)cc3n(c2=O)CCNC3=O)Cl)Cl
|
|
|
253
|
c1ccc(cc1)c2nc(co2)COn3c4ccccc4nn3
|
|
|
254
|
c1ccc(cc1)c2nn(c(=O)o2)CN3CCOCC3
|
|
|
255
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(cnc(n2)N3CCCC3)Cl
|
|
|
256
|
Cc1cc(nc(n1)n2c(cc(n2)c3ccco3)N)C
|
|
|
257
|
Cc1cc(no1)N[C@@]2(C(=O)N=C([N-]2)c3ccccc3)C(F)(F)F
|
|
|
258
|
C[C@@H](c1cccc(c1)F)Oc2cccc3n2c(nn3)c4c[nH]cn4
|
|
|
259
|
CC(C)(C)OC(=O)NCc1[nH]nc(n1)c2ccccc2
|
|
|
260
|
Cc1cc(c(cc1Cl)C)SC(=O)N/C=C/c2ccco2
|
|
|
261
|
Cc1cnc(cn1)C(=O)N2CCC[C@@H](C2)c3cc(=O)[nH]c(n3)C
|
|
|
262
|
Cc1c(oc2c1c3nc(nn3cn2)c4cccnc4)C
|
|
|
263
|
c1cnc(nc1C(F)(F)F)OCn2ccc(n2)C(=O)[O-]
|
|
|
264
|
c1ccnc(c1)c2ccn(c2)c3cccc(c3)C#N
|
|
|
265
|
CCc1cc2c(cc1O)OC=C([C@@H]2O)c3ccc4ccccc4n3
|
|
|
266
|
|
|
|
267
|
c1cc(ccc1c2ccnc(n2)Cn3cncn3)F
|
|
|
268
|
CC1=C([C@@H](C(=C(O1)N)C(=O)OC)c2ccc[nH]2)C(=O)N
|
|
|
269
|
c1ccc(cc1)[C@@H]2C3=C(CCCC3)[NH+]=C4N2NN=N4
|
|
|
270
|
CC(=O)Nc1nccc(n1)c2cc(no2)c3ccccc3
|
|
|
271
|
COc1ccc(cc1OC2CCCC2)c3ccc(nc3)C(=O)N
|
|
|
272
|
CC(=O)NC1=C(c2ccccc2C1)C3=Cc4ccccc4C3
|
|
|
273
|
|
|
|
274
|
c1ccc(cc1)c2nnn(n2)Cc3ccn(n3)c4ccccc4
|
|
|
275
|
COc1cc(cnc1)c2c3c(ccs3)ncn2
|
|
|
276
|
Cc1nc2cc([nH]c2c(n1)N3CCC=CC3)c4ccccc4
|
|
|
277
|
Cc1ccc(cc1)S/C=C/c3ccccc3C(=O)N2
|
|
|
278
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3ccc4c(c3)OCO4
|
|
|
279
|
c1ccc(c(c1)c2nnc3n2N=C(CS3)c4ccc(cc4)F)O
|
|
|
280
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
|
281
|
CC1(Cc2ccccc2C(=[NH+]1)c3cc4ccccc4oc3=O)C
|
|
|
282
|
CCC[C@@H](C)n1c(nc2c1nccc2c3ccc(nc3C)O)CC
|
|
|
283
|
Cc1cc(=O)n2c(n1)sc(n2)n3cnc(n3)C#N
|
|
|
284
|
CCOC(=O)C1=C(C[C@@H](N[C@@H]1c2ccccc2)c3ccccc3)N
|
|
|
285
|
Cc1cc(nc(=O)[nH]1)Oc2ccc(=O)n(n2)c3ccccc3
|
|
|
286
|
Cc1cc(nc(n1)C)Oc2cccc(c2)c3nnco3
|
|
|
287
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
|
288
|
Cc1cc2c(o1)cc(nc2Nc3cccc(c3)Cl)C(=O)OC
|
|
|
289
|
CCOC(=O)C1=C(Sc2ccccc2C1)NC(=O)C
|
|
|
290
|
c1ccc(cc1)Cn2c(c(nn2)c3[nH]c4ccccc4n3)N
|
|
|
291
|
c1ccnc(c1)c2cc3cccc4c3n2CCNC4=O
|
|
|
292
|
CC(C)(C)CN1C[C@@H](CC1=O)NC(=O)CCc2cnccn2
|
|
|
293
|
c1ccc(cc1)C(=O)Cc2c(=O)n3c(ccc(n3)[O-])nn2
|
|
|
294
|
c1cc(cc(c1)C(F)(F)F)c2ccc(o2)c3csnn3
|
|
|
295
|
CC(C)(C)OC(=O)N[C@@H](CC#Cc1ccccc1)C(=O)OC
|
|
|
296
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
|
297
|
COCCOC(=O)NCN1CC(NN1)C2CCCCC2
|
|
|
298
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
|
299
|
|
|
|
300
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3cc4c(s3)CCC4
|
|
|
301
|
c1ccc2c(c1)c3c(c(=O)o2)C=Nc4ccccc4N3
|
|
|
302
|
c1ccc(cc1)n2cc(cn2)C(=O)Nc3cccc(c3)c4[n-]nnn4
|
|
|
303
|
c1ccc(cc1)COCn2cnc3c2cnc4c3scc4
|
|
|
304
|
Cc1c(nnn1Cc2c(oc(n2)c3ccccc3)C)C(=O)[O-]
|
|
|
305
|
C[C@@]12CCC3=C([C@@H]1CC[C@@H]2O)CC4CNN(C4C3)C5CCCCC5
|
|
|
306
|
Cc1ccc(cc1)n2c(nnn2)c3csc(n3)c4ccccc4
|
|
|
307
|
c1ccc(cc1)[C@@H]2Nc3c(cnn3c4ccccc4)C(=O)N2
|
|
|
308
|
|
|
|
309
|
Cc1cnc(o1)CN(C)Cc2ccco2
|
|
|
310
|
Cc1cc(c(n1C2CC2)C)C(=O)COc3nnc4n3cccc4
|
|
|
311
|
CC(=O)n1c2ccccc2c3c1sc(c3C#N)N4CCCCC4
|
|
|
312
|
c1ccc(cc1)NC(=O)[C@@H]2CC(=Nc3n2cnn3)O
|
|
|
313
|
CCCCN1c2cccnc2-c3c(cccn3)N=C1c4ccccc4
|
|
|
314
|
c1ccc(cc1)c2nnc3n2-c4ccccc4OC3
|
|
|
315
|
C1CCC(CC1)CNC(=O)/N=C/2N-3C(NS2)CC4C3CCCC4
|
|
|
316
|
CC(C)/N=c/1ccccn1C(=O)COc2ccc(cc2)Cl
|
|
|
317
|
c1ccc(cc1)Oc2cncc3c2cc(s3)c4[n-]nnn4
|
|
|
318
|
Cn1c2ccccc2nc1Cn3nc(nn3)c4ccccc4
|
|
|
319
|
c1cc(sc1)c2nc(co2)Cn3cc(cn3)Cl
|
|
|
320
|
Cc1cc(nc(n1)Nc2nc(on2)COc3ccccc3)C
|
|
|
321
|
c1cc2c(cc1C3CCCCC3)c4c([nH]2)C(=O)CC=C4
|
|
|
322
|
CN1C2C(C(=O)[NH]C1=O)N/C(=C/3C=CC(=O)C(=C3)OC)/C=N2
|
|
|
323
|
CCCSc1[n-]s/c(=NC(=O)Cn2c(=O)ccc(n2)O)/n1
|
|
|
324
|
c1ccc(cc1)n2c(noc2=O)c3cccnc3
|
|
|
325
|
COC(=O)[C@@H](Cc1cncn1Cc2cc(cc(c2)Cl)Cl)N
|
|
|
326
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
327
|
c1ccc(cc1)c2ncc(cn2)OC(=O)Cc3ccccc3F
|
|
|
328
|
Cc1c(n2cccnc2n1)c3csc(n3)NCC=C
|
|
|
329
|
c1ccc(cc1)C(=O)[C@@H]2C[C@@H]([C@@H]3N2c4ccccc4C=C3)C#N
|
|
|
330
|
CCNc1nc2c(s1)c(c(c(n2)N)C#N)c3ccccc3
|
|
|
331
|
CC(=O)N1CCC(CC1)c2nc3c(c(n2)[O-])nccn3
|
|
|
332
|
c1ccnc(c1)NC(=O)Nc2cccc3c2-c4cccn4C3=O
|
|
|
333
|
C1CCC2C(C1)CC3C(N2)-C4C(C5COCC5C(=O)N4C3)O
|
|
|
334
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
|
335
|
CC(C)CC(=O)N1CCN(CC1)C[C@@H]2C=N[C@@H]3[C@@H]2C=CC=C3
|
|
|
336
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
|
337
|
c1ccc-2c(c1)CCc3n2c(nn3)c4cccnc4
|
|
|
338
|
|
|
|
339
|
CS(=O)(=O)C1=C([N-]C(=C2C=CC(=O)C=C2)N=C1)c3ccccc3
|
|
|
340
|
c1ccn2c(c1)nn(c2=O)CCn3c(noc3=O)c4cccs4
|
|
|
341
|
C1CC(CNC1)C(=O)N2CC3C(N2)C4=C(CCCC4)CC3
|
|
|
342
|
c1c2c(cc3c1OCO3)nnn(c2=O)CCC4=CCC(=O)CC4
|
|
|
343
|
c1ccc2c(c1)OC[C@@H](O2)Cn3cc(nn3)C(=O)N4CCCC4
|
|
|
344
|
CC1CCCC(C1)N2C3NC4CCCCC4N3C(N2)C(=O)C
|
|
|
345
|
CN1C2C(C(=O)N(C1=O)C)NC3C4CCCCC4OC3N2
|
|
|
346
|
Cn1c(cc(c1c2ccsc2)c3ccsc3)c4cccs4
|
|
|
347
|
CCCc1cc(no1)c2cc(=O)n3c([nH]2)c(c(n3)C)CC
|
|
|
348
|
CN1C(CCC1C2=N[C@@H](C=C2)C3CCCCC3)C4CCCCC4
|
|
|
349
|
CC(C)(C)OC(=O)N1CCC=C(C1)c2coc3ccccc3c2=O
|
|
|
350
|
Cn1cnnc1c2cccc(c2)[N-]S(=O)(=O)c3cccnc3
|
|
|
351
|
CC1(CC2=N[C@@H](N=C2C(=O)C1)c3ccccc3)C
|
|
|
352
|
CC(C)(C)C[C@@](Cn1ccnc1)(c2ccccn2)O
|
|
|
353
|
c1ccc(cc1)n2ccc(=O)c(n2)c3cc[nH]n3
|
|
|
354
|
c1cc(ccc1SCCCCn2cncn2)Cl
|
|
|
355
|
C[C@@H]1[C@@H]2[C@@H](C=C3CCCC[C@H]3[C@@H]2/C=C/c4ccccn4)C(=O)O1
|
|
|
356
|
CCOc1nnc(s1)CN(C)Cc2ccco2
|
|
|
357
|
c1ccc(cc1)c2c3ccccc3nnn2
|
|
|
358
|
Cc1ccc(cc1)NC(=O)COc2cn(nn2)c3ccccc3
|
|
|
359
|
C/C=C/C=C/C1CC2CC3C(C(C2C(=O)[NH]1)O)CCC3
|
|
|
360
|
c1ccc(cc1)COC(=O)Nc2ccc3c(c2)CCCC=C3
|
|
|
361
|
c1[nH]c2c(n1)c(ncn2)Nc3c(c4c(s3)CCCC4)C(=O)N
|
|
|
362
|
c1ccc2c(c1)Oc3cc4cc[nH]c4cc3S2
|
|
|
363
|
c1ccc2c(c1)ccc3c2[C@@]4(CCO3)c5ccccc5C=C[C@@H]4O
|
|
|
364
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
|
365
|
COC1CC2C(CC1OC)[C@@H]3CNC(=O)[C@@H]3[C@@H](C2)C4CCCCC4
|
|
|
366
|
CCCCN1[C@@H](c2ccccc2C1=O)Sc3ccc(cc3)F
|
|
|
367
|
c1c2c(c(s1)[C@@H]3[C@H]([C@@H]([C@H](O3)CO)O)O)ncnc2N
|
|
|
368
|
Cc1conc1n2c(=O)nc3ccccc3n2
|
|
|
369
|
|
|
|
370
|
c1cc(oc1)Cn2c(=O)ccc(n2)C(=O)[O-]
|
|
|
371
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
|
372
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
373
|
c1ccc(cc1)c2nc3ccnn3c(n2)[O-]
|
|
|
374
|
Cc1cc(=O)n2c([nH]1)c(c(n2)NC)c3nc(no3)c4ccccc4
|
|
|
375
|
C[C@@H](c1ccc(nn1)Cl)NC(=O)OCc2ccccc2
|
|
|
376
|
CCCc1nc(c(s1)C(=O)Nn2cnc3c2cccc3)C
|
|
|
377
|
Cc1ccc(cc1)S(=O)(=O)NC(=O)n2c(cc(n2)C)C
|
|
|
378
|
Cc1ccc(cc1)c2nc(no2)n3c4ccccc4nn3
|
|
|
379
|
CCOC(=O)c1c2c(c(s1)C)C(=NC3(N2)CCCCC3)O
|
|
|
380
|
c1cc2c(cc1C(=O)Cn3c(=O)cc4c(n3)CCC4)CCO2
|
|
|
381
|
Cc1nnc(s1)SCN2CCN(CC2)c3ccccc3
|
|
|
382
|
c1ccc2c(c1)Nc3cc(ccc3S2)c4cc[nH]n4
|
|
|
383
|
C1CCC2C(C1)C(=C3CC4=CC(=O)C=CC4=C3N2)CL
|
|
|
384
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2c(=O)c3ccccc3nn2
|
|
|
385
|
C1CCC2C(C1)CC3C(N2)-C4CCCC5C4N(C3)CCC5
|
|
|
386
|
Cc1c2cc(c(=O)c(cc2c([nH]1)C)c3ccccc3)c4ccccc4
|
|
|
387
|
c1cc(cc(c1)Cl)c2nnn(n2)c3ccc4nnnn4n3
|
|
|
388
|
COc1cccc2c1ncn(c2=O)Cc3c4c([nH]n3)CCC4
|
|
|
389
|
C[C@@]12C=CC=C[C@@H]1NC(=C3C(=O)c4ccccc4C3=O)C=C2
|
|
|
390
|
C1CCC(CC1)C[S@@](=O)C2CCCCC2CN3CCCC3
|
|
|
391
|
c1cc(cnc1)/C=C/c2cn[nH]c2C3=NCC(=N3)C#N
|
|
|
392
|
c1ccc(cc1)c2c3ccccn3nc2C(=O)c4ccccc4O
|
|
|
393
|
CSc1nnc(n1c2ccccc2)c3cc4c([nH]3)cco4
|
|
|
394
|
Cc1cc(no1)Cn2c(=O)oc(n2)c3ccco3
|
|
|
395
|
CC1=C([C@@H](CC1)C(=C)C)COC[C@@H](COc2ccccc2)O
|
|
|
396
|
Cc1nc(c(o1)NCCc2nc(no2)c3ccccc3)C#N
|
|
|
397
|
CCOCc1cn(c(nc1=[NH2+])C)CC(=O)c2ccccc2
|
|
|
398
|
CCOC(=O)[C@@H]1[C@@H](N=C(N=C1C)O)/C=C/c2ccccc2
|
|
|
399
|
CCCNc1ccccc1c2nc3c(c(n2)[O-])n[n-]n3
|
|
|
400
|
Cc1c(cnc(n1)C2CC2)c3nc(sn3)Nc4ccccc4
|
|
|
401
|
Cc1c2c(c3ccccc3s2)c4c(n1)CC(C[C@@H]4O)(C)C
|
|
|
402
|
CC1=C([C@@]2(c3ccccc3-c4c2nc(o4)N)C(=O)N1)C(=O)OC
|
|
|
403
|
CC(=O)NC1C=CC(C=C1)CC[C@@H](C(=O)[O-])NC(=O)C
|
|
|
404
|
c1[nH]c(=O)c2c(n1)CCN(C2)[C@@H]3CCOC3=O
|
|
|
405
|
c1ccc(cc1)c2cc(c(o2)c3ccccc3)c4[nH]ccn4
|
|
|
406
|
Cc1ccc(cc1)SCCN(C)Cc2cnc(nc2)OC
|
|
|
407
|
COCCCn1cnc2c(c1=O)c3c(o2)nc4ccccc4n3
|
|
|
408
|
Cc1cs/c(=NC)/n1NC(=O)Nc2ccc(cc2)Cl
|
|
|
409
|
CN(C)c1ccc(cc1)/C=C/C2=NC(=O)N[C@@H](C2)C(F)(F)F
|
|
|
410
|
CC(=C)[C@@H](C(=O)OC)N1C(=O)C(CS1)NCC2CCCCC2
|
|
|
411
|
CCN(CC)c1nc(nc(n1)N)c2nc(on2)C
|
|
|
412
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
|
413
|
c1cc(oc1)CNC(=O)CSc2[nH]ncn2
|
|
|
414
|
c1cc(oc1)CN2C3=NC(=O)[C@@](C3=C(NC2=O)[O-])(C(F)(F)F)O
|
|
|
415
|
CCCC[C@@H]1N=C2C(=NC=N2)c3n1nc(n3)c4cccnc4
|
|
|
416
|
C[C@@H]1c2c[nH]nc2-c3ccccc3N1S(=O)(=O)c4ccccn4
|
|
|
417
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
418
|
c1ccc(cc1)NS(=O)(=O)c2ccc3c(c2)[nH]c(=O)c(=O)[nH]3
|
|
|
419
|
c1ccc(cc1)c2cc(no2)Cn3cnc4c3cccc4
|
|
|
420
|
CC(C)(C)OC(=O)N1C[C@H]([C@@H](C1)C(=O)[O-])c2ccco2
|
|
|
421
|
Cn1c(=O)c(c(cn1)[C@@H](C#N)c2[nH]c3ccccc3n2)Cl
|
|
|
422
|
Cc1c(n(c(=O)n1c2ccccc2)C)NC(=O)NC3CCCC3
|
|
|
423
|
CC1CCN(CC1)c2ncc3c(n2)-c4cn(nc4NCC3)C
|
|
|
424
|
CC(C)(C)c1cc(c2c([o+]1)-c3ccccc3OC2)c4ccccc4
|
|
|
425
|
c1ccc-2c(c1)-c3cccc4c3c2n[nH]c4=O
|
|
|
426
|
Cc1c(sc(n1)C)c2ccnc(n2)N
|
|
|
427
|
|
|
|
428
|
C1CCC(C(C1)C(=O)N)N[C@@H](/C=C/C2CCCO2)C#N
|
|
|
429
|
c1ccc(cc1)n2cc3c(n2)C=C[C@@H]4[C@H]3[C@@H]5[C@H]4C6C=C[C@H]7C5[C@H]7C=C6
|
|
|
430
|
COc1ccc(cn1)c2cccc(c2)c3nc(nc(n3)SC)N
|
|
|
431
|
Cc1c(c(on1)C)COn2c3cc(ccc3nn2)C(F)(F)F
|
|
|
432
|
Cc1c(c2c(c(c1O)C)C[C@@H](O2)CCn3ccc(=O)c(c3C)O)C
|
|
|
433
|
CC(C)S(=O)(=O)c1cscc1NC(=O)Nc2ccccc2
|
|
|
434
|
COC(=O)Cc1nnn(n1)Cc2nc(no2)Cc3ccccc3
|
|
|
435
|
c1ccc(cc1)OC(=O)N2CC=C(C=C2)n3c4ccccc4nn3
|
|
|
436
|
Cn1c(=O)c2ccccc2c(n1)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
437
|
COc1ccc(nn1)Sc2[nH]ncn2
|
|
|
438
|
Cn1cc(nn1)NC(=O)c2ccc(cc2)Cn3cccc3
|
|
|
439
|
Cc1ncc(s1)CN(C)[C@@H](C)c2nc(nc(n2)N(C)C)N
|
|
|
440
|
c1ccc2c(c1)-c3c(cncn3)-c4cccnc4S2
|
|
|
441
|
C[C@@H](c1ccc(c(c1)F)c2ccccc2)c3cc(on3)N
|
|
|
442
|
Cc1[nH]n2c(n1)c(c3c2nc4ccccc4n3)C(=O)NCCOC
|
|
|
443
|
Cc1nc(c(o1)C(F)(F)F)c2nc(on2)c3ccccc3
|
|
|
444
|
c1ccc2c(c1)c(=O)n(cn2)Cc3c(snn3)Cl
|
|
|
445
|
c1ccc2c(c1)[C@@H](C(=O)N2)[C@@H]3C(=O)Nc4ccccc4S3
|
|
|
446
|
c1ccc(cc1)C2=COc3ccccc3O[C@@H]2C(=O)c4ccccc4
|
|
|
447
|
c1ccc(cc1)c2cc([nH]c(=O)n2)Cc3ccc4ccccc4n3
|
|
|
448
|
c1c(c2c([nH]1)CCCC2)c3[n-]n4cnnc4n3
|
|
|
449
|
C1CCC(CC1)C(=O)[C@@H]2C=C[C@@](O2)(C#N)C3CCCCC3
|
|
|
450
|
Cc1cc(no1)c2nnnn2c3ccc(cc3)F
|
|
|
451
|
Cc1c(c(on1)C)C(=O)n2ccc(n2)c3c(nc(o3)C)C
|
|
|
452
|
CSc1cc(nn1C(=O)Cc2ccccc2)c3ccc(cc3)F
|
|
|
453
|
c1cc(ccc1c2c3c(c(ncn3)N4CCCC4)sn2)F
|
|
|
454
|
CCOC(=O)c1c(sc2c1Nc3cc(ccc3S2)Cl)C
|
|
|
455
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
|
456
|
c1ccc2c(c1)CCN(C2)Cn3c(ncn3)c4ccccc4Cl
|
|
|
457
|
c1cnc(cn1)NC23C[C@H]4C[C@@H](C2)CC(C4)(C3)n5cncn5
|
|
|
458
|
c1ccc(cc1)Nc2nnnn2NC(=O)Cc3cccs3
|
|
|
459
|
Cc1nc(no1)Cn2c(=O)n(nn2)c3ccccc3
|
|
|
460
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
|
461
|
C[C@@]12C[C@@]3([C@@](c4ccccc4N3)(C)O)O[C@@]1(c5ccccc5N2)C
|
|
|
462
|
c1ccc2c(c1)c(cs2)c3cnc(cn3)N
|
|
|
463
|
CCC(=O)n1c2ccccc2c3c1Nc4ccccc4N3
|
|
|
464
|
CC1=C([C@@](C(=O)N1)(C(F)(F)F)Nc2ccccn2)C(=O)OC
|
|
|
465
|
c1ccc2c(c1)C(=O)C(=O)N2CSc3nnc(o3)c4ccco4
|
|
|
466
|
COC1=C[C@@H]([C@@](C=C1OC)(c2ncccn2)OC)C(=O)N
|
|
|
467
|
C=CCNc1c(c(c(o1)C(=O)c2ccccc2)N)C#N
|
|
|
468
|
c1ccc2c(c1)ccn2CCc3nc(on3)CC#N
|
|
|
469
|
CCOC(=O)c1c(c(c([nH]1)c2c(nc3ccccc3n2)C)C#N)N
|
|
|
470
|
CC1CCC(CC1)S(=O)(=O)NC2CC(C3C(C2C)CCN=C3)C
|
|
|
471
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
|
472
|
c1ccc2c(c1)ncc(n2)Sc3nccs3
|
|
|
473
|
c1ccn2cc(nc2c1)Cn3cc(cn3)N
|
|
|
474
|
c1ccc(cc1)C(=O)n2c(=[NH2+])c(nnc2N)Nc3ccc(cc3)F
|
|
|
475
|
C1CNCC2C1NN(N2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
476
|
c1ccc(cc1)n2cncc2c3nnc(o3)c4cccc(c4)Cl
|
|
|
477
|
Cc1c(c2nc(c3c(n2n1)OCC3)C(=O)[O-])c4ccccc4
|
|
|
478
|
C1CCN(C1)S(=O)(=O)c2c(nc(nn2)[O-])[O-]
|
|
|
479
|
Cc1c(c(no1)c2ccccc2)c3nnc(o3)COC(=O)C
|
|
|
480
|
COC1CCC(CC1)/C=C/2C(=C)[NH]N(C2=O)CC3CCCCC3
|
|
|
481
|
c1cc(oc1)[C@@H](c2c(n3c(s2)ncn3)[O-])N4CCOCC4
|
|
|
482
|
Cc1c(n(c(c1C#N)NC(=O)c2cccs2)CC3CC3)C
|
|
|
483
|
Cc1cc(c(c(=O)o1)Cc2cc(c3cccnc3c2O)Cl)O
|
|
|
484
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
|
485
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
|
486
|
C=CCn1c(=O)n(c(=O)n(c1=O)CC(=O)c2ccccc2)CC=C
|
|
|
487
|
c1ccc(cc1)c2nc([o+]c(n2)c3ccccc3)c4ccccc4
|
|
|
488
|
c1cc(sc1)c2c(c(oc2c3cccs3)N)C#N
|
|
|
489
|
CC1=C([C@@H](N2C(=N1)N=CN2)c3ccccc3)C(=O)N
|
|
|
490
|
CC(=O)N1CCC(=CC1)c2c[nH]c3c2cccn3
|
|
|
491
|
CCOC(=O)c1nc(on1)Oc2ccc(cc2Cl)Cl
|
|
|
492
|
c1ccc(cc1)C2=C(C=NC(=C3C=CC(=O)C=C3)N2)c4cnccn4
|
|
|
493
|
CC(C)(C(=O)c1cnoc1N)n2cncn2
|
|
|
494
|
Cc1ccc(cc1)Nc2nc(nc(n2)N)c3cnn(c3)C
|
|
|
495
|
C1CCC(CC1)C2C(C(=O)C2=O)/C=C/NC3CCCCC3
|
|
|
496
|
|
|
|
497
|
C1CCC(CC1)NN2CNC3C2C4CCCCC4CC3
|
|
|
498
|
CCn1cc2c(n1)c(=O)n(nn2)C3CCCCC3
|
|
|
499
|
c1ccc(cc1)n2c(=O)c3cnc4c(c3[nH]2)cc(s4)C(=O)[O-]
|
|
|
500
|
c1ccc(cc1)c2cc3c(nc2)CCc4c(cccc4C#N)C3
|
|
|
501
|
CCc1c2c(n(n1)C3CCCC3)C(=O)N(CC2)c4ccccc4
|
|
|
502
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
503
|
CNc1c2c(c3c(n1)oc(n3)c4ccccc4)n(cn2)C
|
|
|
504
|
c1ccc(cc1)c2nc(sn2)n3ccc(n3)C(F)(F)F
|
|
|
505
|
c1cnnc(n1)c2nccnn2
|
|
|
506
|
c1ccc2cc(ccc2c1)n3c(nnn3)c4c[nH]c5c4cccc5
|
|
|
507
|
c1ccc(cc1)n2ccc(n2)Nc3nccc(n3)C(F)(F)F
|
|
|
508
|
CC1(Cc2cc(ccc2CO1)S(=O)(=O)Nc3ccccc3)C
|
|
|
509
|
CC(C)(C)c1csc(n1)c2ccc(nc2)n3cncn3
|
|
|
510
|
c1ccc2c(c1)C(=O)[C@@H](O2)c3cnc4ccccc4n3
|
|
|
511
|
c1ccc(cc1)[C@@H]2N(C(=O)C=C(O2)c3ccccc3)c4ccccc4
|
|
|
512
|
Cc1c(nc(c(c1C#N)C#N)OC)/C=C/c2ccco2
|
|
|
513
|
CCOC(=O)Nc1cc2c(c(n1)N)N=C(CO2)c3ccccc3
|
|
|
514
|
Cc1c(nc2ccccc2n1)c3cscn3
|
|
|
515
|
c1ccc(cc1)C#CNCCOc2ccccn2
|
|
|
516
|
Cc1c(oc(n1)Cn2c(=O)oc(n2)c3ccco3)C
|
|
|
517
|
Cc1c(c(on1)C)Cn2nc(nn2)c3ccco3
|
|
|
518
|
c1ccc(cc1)CNC(=O)[C@@H]2CC(=Nc3n2ncn3)[O-]
|
|
|
519
|
C[C@@H](c1ccco1)/N=c/2ccccn2C(=O)Nc3ccccc3
|
|
|
520
|
c1ccnc(c1)c2c([nH]cn2)c3ccsc3
|
|
|
521
|
c1ccnc(c1)[C@@H](C#N)C(=O)c2c(ccs2)n3cnnn3
|
|
|
522
|
C=CCSc1cc(cc(c1C#N)c2ccccc2)C3CC3
|
|
|
523
|
CSc1c([n-]c(n1)c2ccccc2)S(=O)(=O)c3ccccc3
|
|
|
524
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
|
525
|
COc1ccc(cc1)c2cc-3n(n2)C(=O)c4c3cccc4
|
|
|
526
|
Cc1cc(c(c(c1)C)Nc2nc(nc(n2)N3CCC=CC3)C)C
|
|
|
527
|
c1ccc2c(c1)C=C(CO2)c3nnc(o3)c4cccnc4
|
|
|
528
|
CSc1nc(cc(n1)Cl)[C@@H](C#N)c2cc3ccccc3cn2
|
|
|
529
|
Cn1c(ccn1)[C@@H]2C(=C(C(=O)O2)[O-])c3ccc4ccccc4n3
|
|
|
530
|
c1cc([nH]c1)c2nnc(o2)Sc3ccc(cn3)C#N
|
|
|
531
|
c1cc(ccc1c2nc(cs2)SCC(=O)[O-])Cl
|
|
|
532
|
c1ccc(cc1)NC(=O)C[C@@H]2C(=O)NC(=[NH+]2)N3CCCCC3
|
|
|
533
|
Cc1c(sc(n1)NC(=O)C)c2nc(no2)c3ccccc3
|
|
|
534
|
c1ccc(cc1)c2c(nc([nH]2)c3ccco3)N
|
|
|
535
|
c1ccc(cc1)c2nc(co2)COc3cn(nn3)c4ccccc4
|
|
|
536
|
CC(C)[C@@H](NC(=O)OCc1ccccc1)n2cncn2
|
|
|
537
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
|
538
|
|
|
|
539
|
CC1([C@@H]2CCC(=C)[C@@H](C2)C(=N1)C(=O)C3C[NH]C4C3CCCC4)C
|
|
|
540
|
CCCc1nn2c(nnc2o1)c3ccccc3
|
|
|
541
|
CCCCCNS(=O)(=O)c1csc(n1)c2ccc(cc2)F
|
|
|
542
|
CC[C@@]1(C(=O)NC(=N1)c2c(cccn2)C(=O)[O-])C
|
|
|
543
|
C[C@@H](c1nc(no1)Cc2cccs2)n3cccn3
|
|
|
544
|
c1ccc(cc1)c2cn(c(n2)N)NC(=O)Nc3ccc(cc3)F
|
|
|
545
|
c1cnoc1c2nc(no2)CS(=O)(=O)c3ccsc3
|
|
|
546
|
Cc1c(c([nH]c1/C=C/2C(=C(C(=O)N2)C)C=C)OC)CCC(=O)[O-]
|
|
|
547
|
CCc1c2cc(ccn2c(=O)c3c1s[nH]c3=O)c4ccncc4
|
|
|
548
|
Cc1cc(c(c(c1)C)OS(=O)(=O)n2cncn2)C
|
|
|
549
|
c1c(c2c([nH]1)ncnc2N3CCc4c([nH+]c[nH]4)C3)Cl
|
|
|
550
|
c1ccc(cc1)c2c3c(n[nH]2)NC(=O)C[C@H]3c4cccs4
|
|
|
551
|
C[C@H]1CCCN(C1)C2=c3ccccc3=[NH+]/C(=C/C=CC=CC4=O)/N2
|
|
|
552
|
CC1C(NC(C(N1)C(=O)NC)OCC2CCCCC2)C
|
|
|
553
|
CCCCCNC1=[NH+]C(=N/C(=C/C=C(C=CC2=O)Cl)/N1)N
|
|
|
554
|
COc1cccc(c1)C2=CCN(CC2)Cn3cnc(n3)C(=O)OC
|
|
|
555
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
|
556
|
C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)C(=O)NCCCc4[n-]nnn4)C
|
|
|
557
|
Cc1cc(c(cc1N2C(=NC3(C2=O)CCCCC3)C)OC)OC
|
|
|
558
|
c1cc(cc(c1)N/C=c/2ccc3c4c2cccc4c(=O)n3)C(=O)[O-]
|
|
|
559
|
c1ccc(cc1)c2nnc(o2)Cn3c4ccccc4sc3=O
|
|
|
560
|
Cc1c(ccc(=O)n1c2ccccc2)n3c4ccccc4nn3
|
|
|
561
|
c1cc(oc1)C(=O)c2cn(nn2)c3ccc(c(c3)Cl)Cl
|
|
|
562
|
Cc1cn2c3c1CCCCn3c(n2)CN4CCCc5c4cccc5
|
|
|
563
|
Cc1cc(c(n1CC=C)C)C(C)(C)c2cc(n(c2C)CC=C)C
|
|
|
564
|
Cc1ccc(cc1)S(=O)(=O)N2CCc3ccccc3C=C2
|
|
|
565
|
Cc1nc(cs1)c2ccc3c(c2)oc(=O)[nH]3
|
|
|
566
|
c1ccnc(c1)c2c[nH]nc2N3CCOCC3
|
|
|
567
|
c1ccc2c(c1)C(=O)O[C@@]23Oc4cccnc4S3
|
|
|
568
|
CN1C2CCCCC2S(=O) |