(*) Hover the mouse over the Substance number to see a preview of the ZINC link.
Rank |
SMILES |
Substance |
|---|---|---|
|
1
|
c1ccc2c(c1)nnn2CC(=O)/N=c/3[nH]nc4n3cccc4
|
|
|
2
|
c1cc(oc1)c2c(cc3c(n2)[nH]c(=O)[nH]3)c4ccncn4
|
|
|
3
|
Cc1c2c(n[nH]1)Oc3c(c(c(c(=O)[nH]3)C#N)N)[C@@H]2c4ccccc4
|
|
|
4
|
Cc1[nH]c(=O)cc(n1)Cn2cnc3c2cccc3
|
|
|
5
|
c1ccc2c(c1)cc3c(n2)OC(=O)N(C3)C4CC4
|
|
|
6
|
COC(=O)Cn1c(c([nH]c1=O)/C=C/2C=Nc3c2cccc3)O
|
|
|
7
|
Cc1cc(ccc1c2ccc(nn2)c3nnc(o3)COC)F
|
|
|
8
|
|
|
|
9
|
CC(C)[C@@H](C(=O)/N=c/1[nH]cn[nH]1)NC(=O)C
|
|
|
10
|
Cc1cnn(c1)c2cc(ncn2)c3cccnc3
|
|
|
11
|
|
|
|
12
|
Cc1ccc(cc1)NC2=NC(=[NH+]C(N2)(C)C)N
|
|
|
13
|
c1ccc(cc1)CNc2ccnc(n2)n3cnc4c3cncc4
|
|
|
14
|
CCCc1nc(on1)CN2CCc3c(nc[nH]3)[C@@H]2c4ccccn4
|
|
|
15
|
C=CC1(Cc2ccccc2C1)c3c[nH]cn3
|
|
|
16
|
c1ccc2c(c1)c3n(n2)C(=O)c4ccccc4C3=O
|
|
|
17
|
COc1ccc(cc1)/N=c/c3ccccc3[nH]c(=O)cn2
|
|
|
18
|
C1C(C2C([NH]1)C(=O)[NH]CN2)[C@@H]3[C@H]([C@@H]([C@@H](O3)CO)O)O
|
|
|
19
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3cc4c(s3)CCC4
|
|
|
20
|
C1CCC(CC1)CSC2C(C3N[NH]C(=O)N3CN2)N
|
|
|
21
|
c1ccc(cc1)N2CCC(=CC2)c3nc(on3)CCC(=O)[O-]
|
|
|
22
|
Cc1cc(nc(n1)n2c3c(cn2)C(=O)CCC3)C
|
|
|
23
|
c1ccc2c(c1)C[C@@H]3[C@H]([C@@H]2/C=C/c4ccccn4)COC3=O
|
|
|
24
|
c1cc2c(cc1F)c3cnnc(c3[nH]2)SCC(=O)N
|
|
|
25
|
c1ccc2c(c1)nc3c(n2)OC[C@@H]4N3CCCC4
|
|
|
26
|
Cc1cc(nc2c1c3c(s2)c(n[nH]3)c4ccccc4)C
|
|
|
27
|
c1ccc2c(c1)nnn2n3c4ccccc4nn3
|
|
|
28
|
COC(=O)c1c(c2ccccc2[nH]1)n3cnnn3
|
|
|
29
|
Cn1c(ccn1)c2c(cnc(n2)NCc3[nH]ncn3)OC
|
|
|
30
|
CCCCN1Cc2c(nc3cc(nn3c2[O-])C(C)(C)C)C1=O
|
|
|
31
|
c1ccc(cc1)n2c3=CNc4ccccc4N=c3[nH]c2=O
|
|
|
32
|
CCN1C=C([C@@H](NC1=O)c2ccccc2)c3csc(n3)C
|
|
|
33
|
c1ccc(c(c1)OCC(=O)c2ccc[nH]2)F
|
|
|
34
|
c1ccc2c(c1)Cc3nc(=O)c4ccccc4n3C2
|
|
|
35
|
c1ccc2c(c1)[nH]c(n2)Sc3ccc(o3)CO
|
|
|
36
|
c1ccc2c(c1)-c3nc4ccccc4n3[C@H](N2)c5ccco5
|
|
|
37
|
Cc1c2c(n[nH]1)C=C(C[C@@H]2c3ccco3)c4ccco4
|
|
|
38
|
c1ccc2c(c1)ncn2c3c(snn3)C(=O)N
|
|
|
39
|
CCOc1nnc(s1)Cn2c(noc2=O)c3ccccc3
|
|
|
40
|
CC1=[NH+][C@](C[C@H](N1)c2ccccc2)(C(F)(F)F)O
|
|
|
41
|
c1cc(oc1)c2nnc(o2)CN3CCOCC3
|
|
|
42
|
c1ccc2c(c1)[nH]c(=NC(=O)c3ccc[nH]3)[nH]2
|
|
|
43
|
C1CCC2C(C1)NC(C3N2NNN3)CC(=O)NCCO
|
|
|
44
|
CC(=O)NCn1cc(c(=O)o1)c2ccc(cc2)c3ccccn3
|
|
|
45
|
c1ccc(cc1)[C@@H]2C(=O)Oc3cccnc3S2
|
|
|
46
|
c1ccc2c(c1)C(=CS2(=O)=O)Sc3nc[n-]n3
|
|
|
47
|
c1ccc2c(c1)nc3c(c(oc3n2)N4CCCC4)C#N
|
|
|
48
|
c1cc(oc1c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4)[C@@H]5CCCCO5
|
|
|
49
|
CCCCc1[nH]cc(n1)c2[nH]c3cc4c(cc3n2)[nH]c(=O)[nH]4
|
|
|
50
|
COC(=O)[C@@H]1c2c(oc3cc(cc(c3c2=O)O)CO)C=C[C@@H]1O
|
|
|
51
|
CC(C)C1C(C2CC3C(CC2NN1)C4CCCCC4O3)N
|
|
|
52
|
c1ccc2c(c1)c3cc(c(cc3o2)n4cccc4)N
|
|
|
53
|
CC1CC2N(N1)C(=O)C3CC4CCCCC4CC3O2
|
|
|
54
|
c1ccc2c(c1)nc(o2)C3=CNc4ccccc4N=C3
|
|
|
55
|
C1CCC2C(C1)NC3N2[N-]C(N3)C4CCCO4
|
|
|
56
|
COc1ccc(cc1)c2c(c3c(ncnc3[nH]2)N)C#N
|
|
|
57
|
CC(C)[C@@]1(C(=NC(=N1)c2c(cc3ccccc3n2)C(=O)[O-])O)C
|
|
|
58
|
c1ccc2c(c1)Oc3cc4cc[nH]c4cc3S2
|
|
|
59
|
c1cnc(nc1[O-])SCC(=O)Nc2nccs2
|
|
|
60
|
CC(=O)N1C=Cc2ccccc2[C@@H]1c3c[nH]c4c3cccc4
|
|
|
61
|
CC(=O)N1CCC(=C2c3ccccc3CCc4c2nccc4)CC1
|
|
|
62
|
c1nnc(s1)NC(=O)[C@H]2C(=C3CCCCC3=NC2=O)[O-]
|
|
|
63
|
Cc1ccc(cc1)[C@@H]2Cc3c(c[nH]n3)C(=O)C2
|
|
|
64
|
Cc1ccc(c(c1)C)c2cc3n(c2)nc(n3N)C
|
|
|
65
|
c1ccc2c(c1)nc3=c4ccc(cc4=c3n2)Cl
|
|
|
66
|
c1ccc2c(c1)[C@@H]3[C@H]4C(=Nc5ccccc5N3C2=O)CCCC4=O
|
|
|
67
|
c1[nH]c(=O)c2c(n1)Oc3c(c(=O)[nH]cn3)C2
|
|
|
68
|
c1ccc(cc1)c2c(c(c[nH]2)c3ccco3)C(=O)[O-]
|
|
|
69
|
CCc1nc([nH]n1)Sc2nc3ccccc3o2
|
|
|
70
|
Cc1c(c(n[nH]1)n2cnc3ccccc3c2=O)c4ccccc4
|
|
|
71
|
C1CCC2C(C1)C(=O)N-3C(N2)CSC4C3CCCC4
|
|
|
72
|
CC1=CC=CN2C1=[NH+]C(=C3C2=NC(=O)C[C@@H]3c4ccc(cc4)F)[O-]
|
|
|
73
|
CCc1ccn2cc(nc2c1)Nc3ccccc3Cl
|
|
|
74
|
c1ccc2c(c1)c(=O)n-3c(n2)C(=O)c4c3cccc4
|
|
|
75
|
CC1CCCC(C1)N2C3NC4CCCCC4N3C(N2)C(=O)C
|
|
|
76
|
CCn1c2c(cc3ccccc3n2)/c(=N/C(=O)CCC(=O)[O-])/[nH]1
|
|
|
77
|
c1ccc(cc1)/C=C/c2cc([nH]n2)CCc3[nH]c4ccccc4n3
|
|
|
78
|
c1ccc(cc1)n2cnnc2CC(=O)c3ccc(cc3O)O
|
|
|
79
|
c1ccc(cc1)[C@@H]2N(C(=O)C=C(O2)c3ccccc3)c4ccccc4
|
|
|
80
|
CC(C)/C=C/c2nc3c(c(=O)n2[C@@H](C(=O)N1)C(C)C)C=CC=CO3
|
|
|
81
|
|
|
|
82
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2n4cnc(n4)C#N
|
|
|
83
|
c1ccc(cc1)CS(=O)(=O)n2cnc3c2[nH]c(=O)[nH]c3=O
|
|
|
84
|
Cc1ccc(cc1)SCc2nc([nH]n2)N
|
|
|
85
|
c1ccc2c(c1)c(c[nH]2)Cc3c[nH]c4c3CCC=C4
|
|
|
86
|
CN([C@@H]1[C@@H]([C@@H]([C@@H]([C@@H](O1)CO)O)O)O)C(=O)c2[nH]ncn2
|
|
|
87
|
C1C[C@@H]2C[C@H]1[C@@H]3C2=Cc4c([nH]c(=O)s4)S3
|
|
|
88
|
Cc1c(cno1)c2cnc(s2)c3ccccn3
|
|
|
89
|
C[C@@H]1Nc2ccccc2-c3n1c4ccccc4n3
|
|
|
90
|
c1ccc2c(c1)C=C[C@H]3N2C[C@@H]4[C@@H]3[C@H]5CO[C@@H](C4=O)O5
|
|
|
91
|
c1ccc2cc(ccc2c1)n3c(nnn3)c4c[nH]c5c4cccc5
|
|
|
92
|
Cc1c(n2c(=O)n(c(=O)n2c1=O)c3ccccc3)C
|
|
|
93
|
C=CCN1C2CCCCC2C(C1O)C3=C4CCCCC4=NC3=O
|
|
|
94
|
c1ccc2c(c1)C(=O)Nc3ccccc3S2
|
|
|
95
|
CC(C)CNS(=O)(=O)/N=C(/c1c[nH]c2c1cccc2)[O-]
|
|
|
96
|
Cc1c(c(n[nH]1)C)Sc2c(=O)[nH]c(nn2)[O-]
|
|
|
97
|
|
|
|
98
|
c1ccc2c(c1)nc3c(n2)SC4=NC(=O)CC(=O)N34
|
|
|
99
|
CCOC(=O)C1=C(C[C@@H](N[C@@H]1c2ccccc2)c3ccccc3)N
|
|
|
100
|
c1ccc-2c(c1)CCc3c2nnn3c4ccc(cc4)Br
|
|
|
101
|
CN(C)c1nc(nc(n1)N)COn2c3ccccc3nn2
|
|
|
102
|
CC1(/C(=C(Nc2ccccn2)/O)/C(=O)c3ccccc3S1)C
|
|
|
103
|
Cc1cnc(c(c1OC)C)C[C@@H]2Nc3ccccc3S2
|
|
|
104
|
Cc1cc(n[nH]1)C(=O)c2c([nH]n(c2=O)C)c3ccncc3
|
|
|
105
|
c1cc(oc1)c2cc3nc4c(c(n3n2)[O-])SCC4
|
|
|
106
|
C1CC(CCC1C(=O)N2CCC[C@H](C2)C3CCN[NH]3)F
|
|
|
107
|
C=c1cc(n-2/c(=Cc3ccncc3)/c(=O)nc2[nH]1)[O-]
|
|
|
108
|
c1ccc(cc1)C(=O)c2c3ccccn3nn2
|
|
|
109
|
c1[nH]c2c(n1)c(ncn2)Sc3c(=O)[nH]c(=O)[nH]n3
|
|
|
110
|
CCOC(=O)[C@@H]1C2C(NC3CCCCC3N2)N4[C@@H]1CCC4
|
|
|
111
|
CC(C)(C)C1=CC(=O)/C(=c/2cccc3c2=NNN3)/C=C1
|
|
|
112
|
c1ccc(cc1)C(=O)C[C@@H]2c3c([nH]c(=O)s3)SC2=O
|
|
|
113
|
c1ccc2c(c1)OC[C@@H](O2)c3ncc(c(n3)N)C#N
|
|
|
114
|
C[C@@H]1CC2=C([C@@H](Sc3ccccc3N2)c4ccccc4)C(=O)C1
|
|
|
115
|
c1ccc(cc1)c2cc3c(cn2)[nH]nc3N
|
|
|
116
|
c1ccc2c(c1)C[C@@]3(c4ccccc4C=C3NC2=O)O
|
|
|
117
|
C1CCC2C(C1)[NH]C(=O)C(N2)C(=O)[C@@H](C3CCCO3)O
|
|
|
118
|
c1ccc(cc1)c2c3ccccc3[nH]c(=O)c2Sc4[nH]cnn4
|
|
|
119
|
|
|
|
120
|
c1ccc(cc1)C2=C[C@@H](N3C(=[NH+]2)N=NN3)c4ccco4
|
|
|
121
|
c1cc(oc1)C(=O)NCCc2c[nH]cn2
|
|
|
122
|
Cc1cc2c(c(=O)o1)[C@@H](Sc3ccccc3N2)c4ccco4
|
|
|
123
|
Cc1c(cccn1)c2cc3cccnc3n2CCC(=O)[O-]
|
|
|
124
|
c1cc2c(nc1)Nc3c(c(=O)nc([nH]3)N)S2
|
|
|
125
|
C1CCC2C(C1)CCC3C(C4CCCCC4[NH]3)C2
|
|
|
126
|
c1ccc2c(c1)[C@@H](C(=O)N2)[C@@H]3C(=O)Nc4ccccc4S3
|
|
|
127
|
CCN1CNC(=NC1)Nc2nc(c3ccccc3n2)C
|
|
|
128
|
CC(=O)c1c-2n(n(c1=O)c3ccccc3)C(=O)c4c2nccn4
|
|
|
129
|
c1ccc2c(c1)ncn2Sn3cnc4c3cccc4
|
|
|
130
|
Cc1ccc(cc1)C2=Cc3ccccc3NC=C2
|
|
|
131
|
COc1ccc(cc1)c2cc-3n(n2)C(=O)c4c3cccc4
|
|
|
132
|
c1ccc(cc1)C2=Nc3nnnn3[C@@H](C2)c4ccccc4Cl
|
|
|
133
|
CCN(CC)C1C(NNC2N1NC3C2CCCN3)C
|
|
|
134
|
c1ccc(cc1)n2c(=O)c-3c4n(nnc3n2)CCC4
|
|
|
135
|
CCc1nnc(o1)Cn2c(noc2=O)c3ccccc3
|
|
|
136
|
CC(=O)c1ccc2=c3cc(ccc3=c2c1)C(=O)C
|
|
|
137
|
Cc1ccc2c(c1)-c3cc(nn3[C@H](N2)c4ccccc4)C
|
|
|
138
|
c1ccc2c(c1)CCc3ccccc3NC2
|
|
|
139
|
c1ccc(cc1)C2=C/C(=C/c4ccccc4NC3=O)/C(=O)O2
|
|
|
140
|
CCc1nc([nH]n1)Sc2cnc3ccccc3n2
|
|
|
141
|
c1c2c(cc3c1OCO3)nnn(c2=O)CCC4=CCC(=O)CC4
|
|
|
142
|
Cc1[nH]c(=O)c2c(n1)c3c(s2)NC(=O)C[C@@H]3c4ccccc4
|
|
|
143
|
CCn1c(ccn1)[C@@H]2CCCN2C(=O)NCC(=O)OC
|
|
|
144
|
c1ccc2c(c1)nc3c(n2)-c4c(non4)CC3
|
|
|
145
|
Cc1ccc(c2c1cc3c(n2)OCC(=O)N(C3)C4CC4)C
|
|
|
146
|
CC1(COC(=N1)CN(Cc2ccccc2)Cc3ccccc3)C
|
|
|
147
|
CCCc1nc(c2n1nc([nH]c2=O)c3ccccc3OCC)C
|
|
|
148
|
CNC(=O)N(C)C1=N[C@@](C(=N1)C2CCCCC2)(C3CCCCC3)O
|
|
|
149
|
c1ccc2c(c1)CCN(C2)C(=O)/N=c/[nH]c(n[nH]3)c4ccco4
|
|
|
150
|
c1ccc(cc1)S(=NC(=O)c2ccco2)c3ccccc3
|
|
|
151
|
|
|
|
152
|
Cc1ccc2c(c1)[C@@H]3[C@@H]4CC[C@@H](C4)[C@@H]3[S@@](=O)N2
|
|
|
153
|
CC1CC2CC3CCCNN3C2NN1
|
|
|
154
|
Cc1ccc(cc1)/N=C/Cc2c(nnc(n2)SCC=C)C
|
|
|
155
|
c1ccc(cc1)[C@H]2[C@@H]3CCCO[C@@H]3NC(=O)N2
|
|
|
156
|
c1ccc(cc1)C2=Nc3ccccc3NC=C2
|
|
|
157
|
CCOC(=O)C1=C(NC(=O)NC1)Cn2c(=O)c3ccccc3nn2
|
|
|
158
|
c1ccc2c(c1)C[C@@H](N2)Cn3c4ccccc4nn3
|
|
|
159
|
c1cc2c3c(c1)[nH]cc3[C@@H](OC2=O)NC(=O)N
|
|
|
160
|
Cc1ccc2c(c1)SC=C(O2)c3ccccc3
|
|
|
161
|
CCCC[C@@H]1N=C2C(=NC=N2)c3n1nc(n3)c4cccnc4
|
|
|
162
|
CC1(OC(=O)C(=c2c3cccc4c3c([nH]2)ccc4)C(=O)O1)C
|
|
|
163
|
CCOc1c2c(cc([nH]2)C(=O)OCC)nc(n1)OCC
|
|
|
164
|
CCOC(=O)c1c(c([nH]c1C)c2cn3ccccc3n2)C
|
|
|
165
|
C=CCc1nc(c2n1cccc2)N3CCOC3=O
|
|
|
166
|
c1cc2c3c(c(ncn3)n4cccn4)sc2nc1
|
|
|
167
|
c1ccc(cc1)N2CCCn3c4ccccc4nc3C2
|
|
|
168
|
CN1C(=O)C(C(CN1)SC2NC3CCCCC3S2)CL
|
|
|
169
|
CCOC(=O)c1nn(c2n1c(=O)c(nn2)C)c3ccccc3
|
|
|
170
|
Cc1cc2nnc3c(c(c(nc3n2n1)N)C#N)N
|
|
|
171
|
c1ccc(cc1)[C@@H]2C=C(N3C(=N2)N=NN3)c4ccccc4
|
|
|
172
|
Cc1c(nc2ccccc2n1)c3[nH]c(=O)[nH]n3
|
|
|
173
|
COC(=O)[C@@]12CC3CCCCC3[C@@H]([C@@H]1C4C2CCCC4)O
|
|
|
174
|
c1ccc2c(c1)Cc3ccccc3NC2
|
|
|
175
|
C=C1/C(=C/C2CCCS2)/C(=O)N([NH]1)C3CCCCC3
|
|
|
176
|
c1cc2c(cc1c3cc[nH]n3)CCO2
|
|
|
177
|
c1ccc(cc1)c2cc3n(c2)c4ccccc4n3N
|
|
|
178
|
c1ccc(cc1)[C@@H]2CC=N[C@@H](N2)Nc3nc4ccccc4o3
|
|
|
179
|
c1ccc(c(c1)Cn2c3c(cccn3)c(n2)c4ccco4)F
|
|
|
180
|
c1ccc2c(c1)[nH]c(=NC(=O)CSc3nncs3)[nH]2
|
|
|
181
|
Cc1nc([nH]n1)/N=C(/N2CCc3cc(c(cc3C2)OC)OC)[O-]
|
|
|
182
|
COC(=O)Nc1c(ccs1)OCc2ccc(cc2)Cl
|
|
|
183
|
Cc1conc1n2c(=O)nc3ccccc3n2
|
|
|
184
|
c1ccc2c(c1)[nH]c(n2)SN3CCCC3
|
|
|
185
|
c1ccc2c(c1)-c3c(cc(c(=O)o3)C(=O)N)CO2
|
|
|
186
|
CCOC(=O)C1=C(N=C2Nc3ccccc3N2[C@@H]1c4ccco4)C
|
|
|
187
|
CSc1[nH]c(=O)cc(n1)c2ccc3c(c2)nns3
|
|
|
188
|
C=CCNC(=O)Cn1c(cc2c1nccc2)[C@@H]3CCCO3
|
|
|
189
|
CSc1nnc(o1)c2cc3c(s2)-c4ccccc4CC3
|
|
|
190
|
c1ccc(cc1)c2c3c([nH]n2)CCC3
|
|
|
191
|
c1ccc2c(c1)nc3c(n2)Oc4ccccc4N3
|
|
|
192
|
C1CC2C(CC1CC3CC[NH]C3)OCO2
|
|
|
193
|
c1cnc2nc(cn2c1)CSc3[nH]ncn3
|
|
|
194
|
C=c1/c(=C/c2cc3ccccc3[nH]2)/c(=O)[nH][nH]1
|
|
|
195
|
CC(C)[C@@H]1[C@@H](N=C(O1)c2ccccc2)n3c4ccccc4nn3
|
|
|
196
|
CCOC(=O)C1=CNc2ccccc2N=C1N
|
|
|
197
|
Cc1c(sc2c1c(nnc2c3ccccc3)N4CCCC4)C#N
|
|
|
198
|
c1cc2cccc3c2c(c1)c(=C(C#N)C#N)[nH]3
|
|
|
199
|
CC1([C@@H]2CCC(=C)[C@@H](C2)C(=N1)C(=O)C3C[NH]C4C3CCCC4)C
|
|
|
200
|
CCO[C@@H]1C=C(Oc2c1cccc2)c3ccc(cc3)F
|
|
|
201
|
Cc1c(c(c2n1Cc3ccccc3C2)C(=O)OC)C(=O)OC
|
|
|
202
|
CCC(=O)NCc1ccccc1c2cncnc2
|
|
|
203
|
c1ccc(cc1)Oc2c(c3ccccc3[nH]2)c4ccco4
|
|
|
204
|
c1ccc2c(c1)c-3nc4ccc(cc4[nH]n3c2=O)N
|
|
|
205
|
CSc1nccc(n1)Sc2cn[nH]n2
|
|
|
206
|
c1ccc(cc1)OCc2[nH]c(c/c(=N/c3ccc(cc3)Cl)/n2)O
|
|
|
207
|
c1ccc(cc1)c2cn(nn2)c3ccccc3
|
|
|
208
|
CCOC(=O)c1cnc2c3c1onc3CCC2
|
|
|
209
|
c1ccc2c(c1)-c3c(nc4ccccc4n3)C5=NNNN25
|
|
|
210
|
c1ccc2c(c1)ncc(n2)/C=C/[C@@H](CO)O
|
|
|
211
|
c1cc([nH]c1)c2c3c(c(s2)c4ccc[nH]4)OCCO3
|
|
|
212
|
C1CC(CCC1/C/2=C/C(=O)OC3CC(CCC3C[C@@H]2O)O)O
|
|
|
213
|
Cc1cc-2nc3ccc(cc3oc2cc1=[N+](C)C)N
|
|
|
214
|
c1ccc2c(c1)nc3n2-c4ccc(cc4CS3)N
|
|
|
215
|
Cc1csc(n1)c2c(c(c(s2)SC)c3cc[nH]n3)C
|
|
|
216
|
c1cc(sc1)c2cc(nc3c2c(c(o3)C(=O)[O-])N)C(F)(F)F
|
|
|
217
|
CC1=CCC(=O)Nc2c1cnn2c3ccc(cc3)Cl
|
|
|
218
|
CCC1NNC(O1)COC(=O)C2CC[NH]N2
|
|
|
219
|
C[C@@H]1CC2=C(C=Nc3ccccc3N2)C(=O)C1
|
|
|
220
|
CC(=O)N1C[C@@H]2CC[C@@]([C@@H]2C1)(c3cccc(c3)OC)O
|
|
|
221
|
Cc1ccc(o1)Cc2cc(c(o2)C)c3ccccc3
|
|
|
222
|
Cc1ccc(cc1)S(=O)(=O)Nn2c3ccccc3nn2
|
|
|
223
|
CC(C)c1c2c(n[nH]1)-c3ccccc3C2
|
|
|
224
|
c1ccc(cc1)n2cc3c(n2)-c4ccccc4NC3
|
|
|
225
|
COC(=O)NS(=O)(=O)C1=Cc2cccc3c2c1ccc3
|
|
|
226
|
c1ccc(cc1)N2CC(=NC2=O)N3CCCC3
|
|
|
227
|
Cc1ccc(cc1)/N=c/2c3c[nH]nc3[nH]cn2
|
|
|
228
|
c1ccc2c(c1)nn(n2)[C@@H](c3ccco3)C(=O)c4cccs4
|
|
|
229
|
c1[nH]c(=O)c2c(n1)[nH]c(n2)n3cncn3
|
|
|
230
|
Cn1cccc1c2c(c([nH]n2)SCc3ccccc3)C#N
|
|
|
231
|
Cc1nc-2c(s1)Cc3c2ccc(c3)OC
|
|
|
232
|
c1ccc(cc1)NC(=O)OCn2cncn2
|
|
|
233
|
Cc1ccc(cc1)Nc2c([nH]c(=O)n2N)O
|
|
|
234
|
C1CCC2CC3C(CC2C1)[C@@]4(C5CCCCC5C(=O)[C@@]4(O3)O)O
|
|
|
235
|
CSc1nnc(n1c2ccccc2)c3cc4c([nH]3)cco4
|
|
|
236
|
Cc1cnc(o1)Cn2cnc3c2cccc3
|
|
|
237
|
CC1=Nc2cc3c(cc2N=C(C1)C)[nH]c(=O)[nH]3
|
|
|
238
|
Cc1nnc(o1)c2c(oc(n2)c3ccccc3)N
|
|
|
239
|
CCC(=O)Nc1cnn(c1)Cc2nnnn2CCOC
|
|
|
240
|
C1CCC-2C(C1)CC3C2NCNC3C4CCCO4
|
|
|
241
|
COc1ccc2c(c1)C=C(CO2)CNc3cccnc3
|
|
|
242
|
C1CCC(CC1)C(=O)C2C3CCCCC3C4N2C(=O)[NH]C(=O)[NH]4
|
|
|
243
|
CC1(C(=Cc2c(nc3ccccc3n2)O1)OC)C
|
|
|
244
|
c1ccc2c(c1)C(=O)[C@@]3([C@@]2(OC(=C3C(=O)[O-])CO)O)O
|
|
|
245
|
Cc1ccc(cc1)[C@@H](C/C=C
2c(cc(n2)C)C)O
|
|
|
246
|
CCOC(=O)C1CC(CN1C)N2C3CCCCC3NN2
|
|
|
247
|
|
|
|
248
|
CCOC(=O)C1=NC2=CCn3ccnc3C2=C1
|
|
|
249
|
CC(C)(C)[C@@H](/C(=C/c1ccc(cc1)Cl)/n2cncn2)O
|
|
|
250
|
Cn1c(nc(n1)/N=c/c(nss2)Cl)SC
|
|
|
251
|
Cc1cc([nH]c1/C=C/C(=CC(=N2)c3cc4ccccc4[nH]3)OC)C
|
|
|
252
|
COC1=CCC(=CC1)CC2CCC[NH]2
|
|
|
253
|
Cc1cs/c(=N/c2c(nc[nH]2)C(=O)N)/n1c3ccccc3
|
|
|
254
|
c1ccc2c(c1)CCC(=C2)c3cccnc3
|
|
|
255
|
Cc1cc(no1)Cn2cc(cn2)c3cnn(c3)c4ccccc4
|
|
|
256
|
COC1CCC(CC1)/C=C/C2=C(CCCO2)C(=O)[O-]
|
|
|
257
|
CC1=NC(=NC(=CC1)C)Nc2[nH]c3ccccc3n2
|
|
|
258
|
c1ccc(cc1)c2c3c(cc(cn3)C(F)(F)F)[nH]n2
|
|
|
259
|
CCSC1[NH]C(=O)C2C(N1)CCN(C2)C3CCCCC3
|
|
|
260
|
Cc1c(c(=O)[nH]c(=O)[nH]1)Cc2nnc(o2)SCC#N
|
|
|
261
|
CCNC(=O)Oc1c2ccccc2on1
|
|
|
262
|
C1CCC(CC1)C(=O)[C@@H]2COC3C2NC4CCCCC4N3
|
|
|
263
|
c1ccc(cc1)S(=O)(=O)Nc2cc3cnnn3c(n2)N
|
|
|
264
|
CCOC(=O)c1c([nH]c(=O)[nH]1)CSc2ccccn2
|
|
|
265
|
Cc1c2cc(sc2nc3c1[nH]c(cc3=O)[O-])c4cccs4
|
|
|
266
|
c1ccc2c(c1)nc(s2)Cc3cn4ccccc4n3
|
|
|
267
|
c1ccc(cc1)[C@@H]2NC(=[NH+]C(=N2)c3ccccc3)c4ccccc4
|
|
|
268
|
Cc1[nH]c(c(n1)[C@@H](c2ccc(cc2)F)C(C#N)C#N)[O-]
|
|
|
269
|
C[C@@H]1Cc2cc3ccccc3c(=O)n2C=C1
|
|
|
270
|
C1CCC2C(C1)N=C3CC4C(=NC5CCCCC5O4)CC3O2
|
|
|
271
|
c1ccc2c(c1)nc3c(n2)Sc4c(cccn4)O3
|
|
|
272
|
c1ccc2c(c1)nn(n2)Cc3ccco3
|
|
|
273
|
CC1(Cc2ccccc2-c3n1c4c(c3)nc5ccccc5n4)C
|
|
|
274
|
c1ccc2c(c1)CN(c3cccnc3O2)c4ccc(s4)C(=O)[O-]
|
|
|
275
|
c1cc(ccc1c2csc3=N[C@H]4CCCN4C(=c23)O)Cl
|
|
|
276
|
Cc1csc(n1)Cc2nc3ccccc3n2C
|
|
|
277
|
CNC(=O)NCCCn1c(=O)n2c(n1)CCCC2
|
|
|
278
|
c1ccc(cc1)[C@@H]2[C@@H]3CCCCC3=C4CCCC[C@@]4(O2)O
|
|
|
279
|
Cc1cc(sn1)[C@@H](c2ccc(cc2)C(C)C)Nc3cccnc3
|
|
|
280
|
Cc1c(sc(n1)Cn2c3ccccc3nn2)C
|
|
|
281
|
Cc1cc(n(n1)C(=O)c2cc3c([nH]2)ccs3)C
|
|
|
282
|
Cc1c(c(n[nH]1)C)Sc2nnc(s2)SC
|
|
|
283
|
Cn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
284
|
c1c(cn(n1)Cc2nc(on2)C(=O)N)Cl
|
|
|
285
|
c1ccc2c(c1)ncn2Cc3nnc(o3)N
|
|
|
286
|
CCN1C=C2[C@@H](CN=C2c3c1cc(cc3)c4ccncc4)O
|
|
|
287
|
c1cc2c(cc1S(=O)(=O)N3CCCCC3)N=C(CS2)O
|
|
|
288
|
c1ccc(cc1)/C/2=N/c3ccccc3NC(=O)c4c2cccc4
|
|
|
289
|
c1ccc2c(c1)nc(o2)Sc3nccs3
|
|
|
290
|
c1ccc2c(c1)Nc3c(cc(nn3)Cl)S2
|
|
|
291
|
Cc1c2c(nc(n1)C)Oc3ccc4ccccc4c3C2
|
|
|
292
|
c1cc(oc1)Cn2c3c(nc2Cl)CCC3
|
|
|
293
|
Cc1c2c(on1)C=C(CC2)c3ccccc3
|
|
|
294
|
|
|
|
295
|
c1ccc2c(c1)Cc3c(c(c(nc3S2)N)C#N)N
|
|
|
296
|
c1ccc2c(c1)N=C(C[C@@H](S2)c3cccs3)c4ccco4
|
|
|
297
|
Cc1ccc(cc1)Sc2c(cccn2)n3cccc3
|
|
|
298
|
Cc1c(c(n[nH]1)O)Sc2[nH]c3ccccc3n2
|
|
|
299
|
c1cc(ccc1Nc2cc(=O)[nH]c(=O)[nH]c2=O)F
|
|
|
300
|
c1ccc(cc1)n2c(c-3sc4ccccc4nc3c2=O)[O-]
|
|
|
301
|
|
|
|
302
|
c1ccc-2c(c1)-c3c2nc4ccccc4n3
|
|
|
303
|
CC[C@@H](C(=O)N1CCC=CC1)Nc2cccc(c2)OC
|
|
|
304
|
Cc1c2cc(cnc2n(n1)C)[N-]S(=O)(=O)c3cccs3
|
|
|
305
|
|
|
|
306
|
c1ccc(cc1)Cc2ccc(nn2)[O-]
|
|
|
307
|
c1ccc2c(c1)c(c-3n[nH+]c4c(nc23)non4)O
|
|
|
308
|
Cc1c2c(nnc(c2[nH]n1)Cc3ccco3)C
|
|
|
309
|
c1ccc2c(c1)[C@@H](C(=O)N2)c3c(cc(cn3)C(F)(F)F)Cl
|
|
|
310
|
c1cc(c(cc1S(=O)(=O)[O-])C(=O)[O-])c2cn[nH]c2[O-]
|
|
|
311
|
|
|
|
312
|
CC1CC(N(N1)C2C3CCCCC3SN2)C
|
|
|
313
|
c1ccc2c(c1)nc(o2)Nc3nc4ccccc4s3
|
|
|
314
|
|
|
|
315
|
COc1ccccc1NC(=O)c2c(cc(s2)C(=O)OC)[O-]
|
|
|
316
|
c1ccc2c(c1)c(=O)n3c4ccccc4oc3n2
|
|
|
317
|
Cc1ccc(cc1)c2ccc[nH]2
|
|
|
318
|
Cc1csc(n1)Sc2nnc(n2C)c3ccccc3
|
|
|
319
|
c1ccnc(c1)CCSc2nncs2
|
|
|
320
|
CCOC(=O)Cc1c([nH]c(=O)nn1)[O-]
|
|
|
321
|
c1ccc2c(c1)[nH]/c(=N/C3=NC(=O)C[C@@H](N3)C(=O)[O-])/s2
|
|
|
322
|
CCOC(=O)c1cc2c3ccccc3oc2s1
|
|
|
323
|
C1CCC(CC1)C(=O)C#CC2C[NH]C(=O)[NH]C2=O
|
|
|
324
|
CC=C(C(=O)N/C1=C/c2ccccn2)C
|
|
|
325
|
C1CCC(CC1)C2=CC(=C[C@@](O2)(C3CCCCC3)O)C4CCCCC4
|
|
|
326
|
C1CCC2C(C1)[C@H](CO2)NC3NCCCN3
|
|
|
327
|
|
|
|
328
|
c1ccc(cc1)c2cc(no2)C(=O)[C@@H](C#N)c3ccccn3
|
|
|
329
|
c1ccc(cc1)n2c(nnn2)SCn3c4ccccc4nn3
|
|
|
330
|
c1ccc(cc1)n2c(=O)n3n(c2=O)[C@H]4[C@H]5[C@@H]3[C@@H](O4)CC5
|
|
|
331
|
COC(=O)c1cc2c(cccn2)oc1=O
|
|
|
332
|
c1ccc2c(c1)nnn2CNC(=O)c3ccco3
|
|
|
333
|
c1ccnc(c1)c2cc([nH]n2)C(=O)NCCn3cncn3
|
|
|
334
|
c1ccc(cc1)c2nnn(n2)Cc3c(snn3)Cl
|
|
|
335
|
COc1ccnc(n1)N2CCn3c4ccccc4cc3C2
|
|
|
336
|
CC1(Cc2c(cc3c4c([nH]c(=O)[nH]4)sc3n2)CO1)C
|
|
|
337
|
c1cc(cnc1)c2nnc(s2)C3CCN(CC3)c4ncccn4
|
|
|
338
|
[H]/N=C/N[C@H](N/C(=N/c2ccc(cc2)C)/N1)c3ccccc3
|
|
|
339
|
c1ccc2c(c1)c3ccc(cc3o2)n4ncnn4
|
|
|
340
|
c1ccc2c(c1)[nH]c(=O)c(n2)n3ccnc3
|
|
|
341
|
c1ccc2c(c1)nc(s2)Cn3cnc(n3)C#N
|
|
|
342
|
C1CNC2C3CNC4C(C3NN2C1)CCS4
|
|
|
343
|
Cc1c(nnn1c2ccccc2)c3nnc(o3)c4ccco4
|
|
|
344
|
C1CCc2c(c3c(s2)N=C4CCCN4C3)C1
|
|
|
345
|
c1ccc-2c(c1)CCCc3n2c(nn3)CC#N
|
|
|
346
|
CN1C(=O)C2C([NH]C1=O)S(=O)(=O)C3CCCCC3C2
|
|
|
347
|
CCCCN1CCc2cccc(c2SC1)C
|
|
|
348
|
Cc1ccnc(c1)Nc2ccc(nn2)NCCNC(=O)C
|
|
|
349
|
Cc1cnc(o1)CSc2ccccc2
|
|
|
350
|
Cc1ccc(cc1)S(=O)(=O)Cc2c([nH]c(=O)[nH]2)C
|
|
|
351
|
|
|
|
352
|
Cc1ccc2c(c1)nc3c(n2)sc(=O)s3
|
|
|
353
|
c1ccc2c(c1)c3c(cn2)c(n[nH]3)N
|
|
|
354
|
c1ccc(cc1)c2cc([nH]n2)n3cnc4c3cccc4
|
|
|
355
|
c1ccc(cc1)S(=O)(=O)[N-]c2c3ccccc3oc2C#N
|
|
|
356
|
c1ccc-2c(c1)CCc3c2nc4c(n3)c(ncn4)O
|
|
|
357
|
c1cc(ccc1[C@@H]2[C@]3([C@@]2(C(=O)N=C3[O-])C#N)C#N)F
|
|
|
358
|
CC1(CC(=O)[C@@H]2[C@H](NC3CCCCC3CC2=N1)C4CCCNC4)C
|
|
|
359
|
c1ccc2c(c1)NC3=C([C@@H](S2)c4ccc(cc4)F)C(=O)OC3
|
|
|
360
|
Cc1c(cc2c(n1)sc(=O)[nH]2)c3ccncc3
|
|
|
361
|
c1ccc2c(c1)ncc(n2)n3cnc(n3)C#N
|
|
|
362
|
Cn1c2cccc3c2c(n1)-c4ccccc4C3=O
|
|
|
363
|
C1CCC2C(C1)CCN2[C@@H]3C4CCCCC4C(=O)O3
|
|
|
364
|
Cc1ccc2c(c1)C[C@@H]3[C@@H](N2)C(=CN(C3=O)C)CO
|
|
|
365
|
C=C1c2ccccc2C=Cc3c1cccc3
|
|
|
366
|
c1ccc2c(c1)C(=O)O[C@@]3(N2C(=O)[C@@H]4[C@@H]3[C@H]5C[C@@H]4C=C5)O
|
|
|
367
|
Cc1cc(on1)n2c(nc3ccccc3c2=O)C
|
|
|
368
|
c1ccc(c(c1)c2[nH]nc(n2)/C=C/c3ccco3)N
|
|
|
369
|
C1CCC(CC1)C2NCC3N2NCN3C4CCCCC4
|
|
|
370
|
CC(=O)N1CCC(CC1)c2c(cnc(n2)C3CC3)c4ccncc4
|
|
|
371
|
CN(C)c1ccc(cc1)[C@@H]2NC[C@@H](O2)CSc3ccccn3
|
|
|
372
|
c1cc(sc1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
373
|
c1ccc(cc1)c2cc(on2)[C@@]3(CC[C@H]4CO[C@@H]3O4)O
|
|
|
374
|
c1ccc2cc3c(=O)c(cc2c1)CCCCC3
|
|
|
375
|
CCOC(=O)/C=C/1C2NNNN2-C3CCCCC3N1
|
|
|
376
|
Cc1c(s/c(=NC(=O)NCc2ccccc2)/o1)C(=O)C
|
|
|
377
|
c1cc(cnc1)C(=O)c2nccn2c3ccc(nn3)[O-]
|
|
|
378
|
c1ccc2c(c1)OC[C@@H](O2)c3nc([nH]n3)N
|
|
|
379
|
|
|
|
380
|
c1ccc(cc1)c2c(c(=O)c2=O)NCc3ccccn3
|
|
|
381
|
c1ccc2c(c1)c(=O)oc3n2nc4c3CCCC4
|
|
|
382
|
c1ccc2c(c1)nc(o2)n3c4ccccc4oc3=O
|
|
|
383
|
c1ccc2c(c1)NC=CC(=N2)c3ccccn3
|
|
|
384
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3ccccn3)O
|
|
|
385
|
Cn1ccnc1c2cnc(nc2c3ccco3)NCCCO
|
|
|
386
|
Cc1cc(nc(n1)n2cc(nn2)C(=O)c3ccccn3)C
|
|
|
387
|
C[C@@H]1CCCC2=C1[C@@H](C3C(CCCC3N)[C@@H]2O)O
|
|
|
388
|
c1cc(cc(c1)C(=O)NCCc2cn3c(n2)CCCC3)C#N
|
|
|
389
|
Cc1cc(n(n1)NC(=O)CCc2ccccc2)C
|
|
|
390
|
c1cc(oc1)[C@@H]2CCCN2S(=O)(=O)c3c[nH]cn3
|
|
|
391
|
CSc1[nH]c(=O)cc(n1)c2ccoc2
|
|
|
392
|
c1ccc2c(c1)CC3=C(O2)c4ccccc4OC3
|
|
|
393
|
CC(C)(C)c1c2c(no1)-c3ccccc3C2=O
|
|
|
394
|
CCc1cc(c(=O)[nH]c1C)CCC2=N[C@@H]3CCCC[C@@H]3O2
|
|
|
395
|
|
|
|
396
|
C=c1/c(=C/c2ccccc2O)/c(=O)o[nH]1
|
|
|
397
|
C1CCC2C(C1)C3C([NH]2)C(=O)C(CS3)C#N
|
|
|
398
|
Cc1cc(c2nncn2n1)n3cc(c(=O)[nH]c3=O)F
|
|
|
399
|
Cc1nc2n(n1)[C@H](CC(=N2)C(=O)[O-])[C@@H]3CCC=CC3
|
|
|
400
|
COC1=C(C(=O)N[C@@H]1C(=O)c2ccccc2)C(=O)OC
|
|
|
401
|
COC(=O)C1=Nn2c3ccccc3nc2CC1
|
|
|
402
|
CCCCc1cn(nn1)CC2CCN(CC2)C(=O)C
|
|
|
403
|
c1ccc(c(c1)C2=N/C(=C/c3ccco3)/C(=O)N2)Cl
|
|
|
404
|
c1ccc2c(c1)-c3ccccc3S(=O)(=O)N2
|
|
|
405
|
c1ccnc(c1)SCCc2c[nH]c[nH+]2
|
|
|
406
|
c1ccc2c(c1)nc3n2nnc4c3cn[nH]4
|
|
|
407
|
c1ccc(cc1)C2=CC(=N[C@@]2(c3ccccc3)O)c4ccccc4
|
|
|
408
|
C1CCC2C(C1)C3C([NH]2)C(=O)CCS3
|
|
|
409
|
c1ccc(cc1)COC(=O)Nc2ccc(=O)[nH]n2
|
|
|
410
|
c1ccc2c(c1)CCc3ccccc3S2
|
|
|
411
|
CC(=O)n1c2ccccc2c3c1oc(c3C(=O)OC)C(=O)OC
|
|
|
412
|
c1ccc(cc1)n2nc3ccc4c(c3n2)non4
|
|
|
413
|
CS(=O)(=O)NC1=NCN(CN1)Cc2ccccn2
|
|
|
414
|
CCOC(=O)[C@@H]1[C@@H]2[C@@H](C3CCCCC3O2)C4CC(CCC4N1)CL
|
|
|
415
|
CNC(=O)c1c(n(nn1)C)Sc2c(nns2)C(=O)NC
|
|
|
416
|
CC1=N/C(=C/c3ccccc3C(=O)O2)/C(=O)O1
|
|
|
417
|
Cc1c(cco1)c2c(cn[nH]2)c3ccnc(n3)N4CCOCC4
|
|
|
418
|
CCOC1=C[C@@H](Oc2c1cccc2)c3ccc(cc3)F
|
|
|
419
|
Cc1csc(n1)c2cc3ccccc3oc2=O
|
|
|
420
|
Cc1cc([nH]n1)Sc2cc(=O)cc(s2)SC
|
|
|
421
|
c1ccn(c1)c2ccc3c(c2)nc[nH]3
|
|
|
422
|
c1ccc(c(c1)c2cc3n(c2)[C@@H](CNC3=O)CC(=O)[O-])F
|
|
|
423
|
c1ccc2c(c1)/C(=N/c3ccccn3)/C(=O)N2
|
|
|
424
|
Cc1c(sc(n1)c2ccccc2)c3nnc(n3C)SC
|
|
|
425
|
c1ccc(cc1)c2cc(=O)[nH]c(=O)s2
|
|
|
426
|
COC(=O)[C@@H](Cc1ccccc1)NC(=O)n2ccccc2=O
|
|
|
427
|
c1ccc(cc1)C2=COc3ccccc3O2
|
|
|
428
|
c1cc2cnn(c2nc1)[C@@H]3C[C@@H]([C@@H](O3)CO)O
|
|
|
429
|
c1ccc2c(c1)c3ccc(nc3[nH]2)N
|
|
|
430
|
CCOC(=O)[C@@H]1[C@@H](N=C(N=C1C)O)/C=C/c2ccccc2
|
|
|
431
|
C1CCC2C(C1)-C3C(CN[NH]3)CCS2
|
|
|
432
|
c1ccc2c(c1)c(c[nH]2)c3c[nH]c(n3)C(=O)c4c[nH]c5c4cccc5
|
|
|
433
|
Cc1cn2c3c(=O)[nH]c(=O)n(c3nc2o1)C
|
|
|
434
|
Cc1ccn(n1)Cc2nc([nH]n2)N
|
|
|
435
|
CCC1=C(OS(=O)(=O)NC1=O)C2CCCCC2
|
|
|
436
|
Cn1c(=O)c(c([nH]1)c2ccncc2)C(=O)c3ccc4c(c3)OCO4
|
|
|
437
|
c1ccc2c(c1)CC[C@@H](C(=N2)O)Sc3[nH]ncn3
|
|
|
438
|
c1ccc(cc1)c2cn3c(n2)scn3
|
|
|
439
|
CC1(Cc2c(c(n[nH]2)/C=C/c3ccccc3)C(=O)C1)C
|
|
|
440
|
C1CC(SC1)C(=O)C2C(=O)C3C(OC2C(F)(F)F)CC=C3
|
|
|
441
|
CN(C)C(=O)c1cc(c[nH]1)c2c(cnc(n2)N)c3ccccc3
|
|
|
442
|
c1ccc2c(c1)[C@@H]3c4c([nH]c(=O)s4)SC=C3CO2
|
|
|
443
|
C1CCC(CC1)CCC2=NC3C(=O)[NH]C(NC3OC2)N
|
|
|
444
|
CCc1ccc(cc1)[C@@H]2c3cc(ccc3-c4c2nc(o4)N)N
|
|
|
445
|
c1ccc2c(c1)Nc3cc(ccc3S2)c4cc[nH]n4
|
|
|
446
|
Cc1cc(c(c(=O)o1)C#Cc2ccccc2)Cl
|
|
|
447
|
Cc1ccc2c3c1noc3-c4ccccc4C2=O
|
|
|
448
|
CC1=NC2=Nc3ccccc3CN2C(=C1)O
|
|
|
449
|
COCC/N=c/c(=C2C=CC(=O)C=C2)[nH]c3=CNC=Cn31
|
|
|
450
|
COc1ccc2c(c1)occ(c2=O)c3ccon3
|
|
|
451
|
Cc1c(n2ccsc2n1)c3nnc(n3C)SCC(=O)NC
|
|
|
452
|
c1ccc(c(c1)C(=O)c2cc([nH]c2)c3nc(no3)C4CC4)O
|
|
|
453
|
CSc1cc(oc1C(=O)c2ccco2)c3ccco3
|
|
|
454
|
c1ccc(cc1)/C=C/c2cccs2
|
|
|
455
|
c1ccc(cc1)c2cc(c(o2)c3ccccc3)c4[nH]ccn4
|
|
|
456
|
C1CCC(CC1)[S@@]2(=NC3C(CCCC3O)C=C2)=O
|
|
|
457
|
Cc1nc(on1)Cc2c[nH]c3c2cccc3
|
|
|
458
|
CCn1cnnc1c2cc(c[nH]2)C(=O)c3ccccc3O
|
|
|
459
|
CCNc1nnc(s1)Cn2c3ccccc3nn2
|
|
|
460
|
c1c2c(cc3c1OCO3)-c4c(c(=O)c4=O)CC2
|
|
|
461
|
c1ccc(cc1)Sc2c3[nH]ncn3c(=O)nn2
|
|
|
462
|
CNc2cc[nH+]cc2N/C1=C/3C=Nc4c3cccc4
|
|
|
463
|
C1CC[C@@H]2N=c3c(=C(N2CC1)N)c4c(s3)CCCC4
|
|
|
464
|
CC(=O)NSC[C@@H](C(=O)[O-])NC(=O)OC(C)(C)C
|
|
|
465
|
c1c(cnc(c1Sc2nc([nH]n2)N)C#N)C(F)(F)F
|
|
|
466
|
Cc1cc(on1)c2cncnc2c3ccc(nc3)N4CCOCC4
|
|
|
467
|
c1ccc2c(c1)CC(C2)(C#N)O[C@@H]3CCCCO3
|
|
|
468
|
Cn1c2c(cn1)[C@@H](CC(=N2)O)C3=Cc4ccccc4OC3
|
|
|
469
|
c1cnccc1c2cnc(c(n2)N3CCN(CC3)CCO)N
|
|
|
470
|
CCc1cc2c(cnc(c2o1)OC)C(=O)Nc3c(cncn3)C#N
|
|
|
471
|
C1CCC(CC1)[C@@H]/2CC3CCCCC3C(=O)O/C=C2
|
|
|
472
|
C[C@@H]1N=C2C=CC=C[C@@H]2C(=O)N1CC=C
|
|
|
473
|
COC(=O)c1c2cccc3c2c(o1)-c4ccccc4C3=O
|
|
|
474
|
Cc1ccc(c(c1)C(=O)c2cnn(c2)c3ncccn3)O
|
|
|
475
|
CN(C)C(=O)Sc1cnc2ncnn2c1
|
|
|
476
|
CCc1nnc(c2n1ccc2)N3CCC(CC3)C(=O)[O-]
|
|
|
477
|
Cc1c(cnc2c1c3cc(ccc3o2)O)C(=O)C
|
|
|
478
|
c1(=O)[nH]c(=O)n2c(n1)sc(n2)S(=O)(=O)N
|
|
|
479
|
c1cc(ccc1Nc2cn[nH]c(=O)c2Cl)F
|
|
|
480
|
Cn1c2cc([nH]c2nc1SC)C(=O)OC
|
|
|
481
|
COc1cccc(c1)C2=CCN(CC2)c3c(cccn3)C#N
|
|
|
482
|
C1Cc2c(sc3c2c(c(c(=O)[nH]3)C#N)N)C1
|
|
|
483
|
c1ccc2c(c1)[C@@H](NC=[NH+]2)Cn3c4ccccc4nn3
|
|
|
484
|
c1ccc(cc1)NS(=O)(=O)c2ccc3c(c2)[nH]c(=O)c(=O)[nH]3
|
|
|
485
|
CC[C@@H]1Nc2ccccc2N1c3ccc(cc3)Cl
|
|
|
486
|
C1CCC2C(C1)C(=C3CC4=CC(=O)C=CC4=C3N2)CL
|
|
|
487
|
CCc1c(nco1)C(=O)N2CCC(CC2)c3cc(=O)[nH]c(n3)C
|
|
|
488
|
Cc1c2ccc3c(c2oc(=O)c1Br)[nH]c(=O)o3
|
|
|
489
|
c1cn[nH]c1c2c(n(nn2)C3CCCCC3)NC4CCCCC4
|
|
|
490
|
CN1C(=O)N2N(C1=O)[C@@H](C3=CC=CC=C[C@@H]32)OC
|
|
|
491
|
c1cocc1c2c(cc3c(n2)CCC3)C(=O)N
|
|
|
492
|
[H]/N=C/1C2=NC(=NC(=O)C2=NC(=O)N1CCC)c3cccs3
|
|
|
493
|
CCN(CC)C(=O)/C=C(/CCCC#N)Sc1ccccc1
|
|
|
494
|
c1ccc2c(c1)nc3c(n2)C(=O)C(=C(C3=O)O)[O-]
|
|
|
495
|
c1cc(ccc1c2c3ccoc3ccn2)C(=O)N
|
|
|
496
|
CC1=C(NC(=O)[C@@H](NC1=O)c2ccccc2)C
|
|
|
497
|
Cc1ccc(cc1)S(=O)(=O)Nn2c(c(nn2)c3ccccc3)C
|
|
|
498
|
CCOC(=O)/C=C/1[C@@](C2CCCCC2O1)(C)O
|
|
|
499
|
CC1(Cc2ccccc2/C(=C/C(=O)N)/C1)C
|
|
|
500
|
CCOc1ccc(cc1)Nn2c(c([nH]c2=O)O)N
|
|
|
501
|
c1ccc(cc1)Nc2nc(nc(n2)N)CN3CCC[C@@H]3C(=O)N
|
|
|
502
|
c1ccc(cc1)c2nnn(n2)c3c4ccsc4ncn3
|
|
|
503
|
Cc1ccc(o1)C2=Nc3ccccc3[N-]C(=N2)c4cccs4
|
|
|
504
|
c1ccc2c(c1)cc(c(=O)o2)/C(=N/c3n[nH]nn3)/[O-]
|
|
|
505
|
c1ccc(cc1)N2Cn3c(=O)ccc(=O)n3C2
|
|
|
506
|
CN(Cc1[nH]c(=O)cc(n1)N)S(=O)(=O)c2ccccc2
|
|
|
507
|
c1ccc2c(c1)c3c([nH]2)cccc3O
|
|
|
508
|
c1ccc(cc1)c2c3ccccn3nc2C(=O)c4ccccc4O
|
|
|
509
|
Cn1cc(nc(c1=O)Nc2ccccc2)Br
|
|
|
510
|
c1ccc2c(c1)CSc3ccccc3N2
|
|
|
511
|
c1ccc2c(c1)c3c([nH]2)-c4ccccc4OCC3
|
|
|
512
|
c1ccc-2c(c1)Cc3c2ccc(c3)n4cccc4
|
|
|
513
|
c1coc(c(c1=O)O)[C@@]2([C@@H]3C[C@@H]([C@@H](O3)CC2=O)C#N)O
|
|
|
514
|
c1ccc2c(c1)[nH]c(n2)c3c(c4cccnc4s3)[O-]
|
|
|
515
|
Cc1c(non1)c2cn3cc(ccc3n2)Br
|
|
|
516
|
c1ccc2c(c1)C(=O)N[C@@]2(c3[nH]ccn3)O
|
|
|
517
|
c1ccc(cc1)n2c(nnn2)Cn3c4ccccc4oc3=O
|
|
|
518
|
C/C=C/C=C/1C=Cc2c1c(=O)occ2C(=O)OC
|
|
|
519
|
CC(C)c1cc(=O)[nH]c(n1)[C@@H]2CCCN2C(=O)CCOC
|
|
|
520
|
c1cc(ccc1C(=O)[O-])Oc2c(nccn2)N3CCCC3
|
|
|
521
|
Cc1c2cnc3ccccc3n2nn1
|
|
|
522
|
c1ccc(cc1)Oc2nc3ccccn3c(=O)n2
|
|
|
523
|
C1CCC(CC1)[C@@H]2CC(=NS(=O)(=O)N2)C3CCCCC3
|
|
|
524
|
C1CCC(CC1)C2NNC(O2)C3C4CCCCC4SN3
|
|
|
525
|
Cc1nc2cccc3c2n1CCN3
|
|
|
526
|
Cc1c(oc(n1)NS(=O)(=O)c2ccc(cc2)N)C
|
|
|
527
|
c1ccc2cc(ccc2c1)Nc3ccc(cc3)O
|
|
|
528
|
c1ccn2c(c1)nc3c2C(=O)CC3
|
|
|
529
|
Cc1cs/c(=Nc2ccccc2F)/n1Cc3cccnc3
|
|
|
530
|
c1ccc2c(c1)ccc3c2c4c([nH]3)C5=C(COC=C5)OC4
|
|
|
531
|
c1ccn(c1)c2ccc(cc2)S(=O)(=O)N
|
|
|
532
|
C[C@@H]1N([C@@H]2c3cccc4c3c(ccc4)[C@@H]2O1)c5ccccc5
|
|
|
533
|
c1ccc(cc1)/C=c/2c3cccc4c3c(o2)ccc4
|
|
|
534
|
Cc1nc2c3c(sc2c(=O)o1)N4CCC[C@@H]4N=C3
|
|
|
535
|
c1ccc(c(c1)[C@@H]2c3ccsc3[C@@H]4CCCC[C@@H]4O2)N
|
|
|
536
|
C=CCSc1cc(cc(c1C#N)c2ccccc2)C3CC3
|
|
|
537
|
c1ccc2c(c1)c(c[nH]2)/C=N/c3nccs3
|
|
|
538
|
c1ccc2c(c1)nnn2Cncccc/c3=NC=C4CCCCC4
|
|
|
539
|
CC1NNC2N1-C3CCCCC3-C4C(C5CCCCC5[NH]4)C2
|
|
|
540
|
Cc1cc(c(c(=O)o1)c2ccn[nH]2)[O-]
|
|
|
541
|
Cc1nc2c(c(=O)n1N)OC3=C(S2)CCCC3
|
|
|
542
|
c1ccc2c(c1)-c3c[nH]c4c3c(ccc4)C2=O
|
|
|
543
|
COC(=O)c1c(cn2c(nnc2n1)N)C(=O)c3ccco3
|
|
|
544
|
c1ccc(cc1)C(=O)Cc2c([nH]nc2N)N
|
|
|
545
|
C1CCNC(C1)[C@@H](C#N)C(=O)C2CNN3C2NCCC3
|
|
|
546
|
c1cc(oc1)C2=NN3C(=N[C@H]4CCCC[C@H]4C35CCCCC5)N2
|
|
|
547
|
c1ccc2c(c1)C(=O)NS(=O)(=O)c3ccccc3S2
|
|
|
548
|
Cc1nc([nH]n1)/N=C(/N(C)Cc2ccco2)[O-]
|
|
|
549
|
c1[nH]c(=O)c2c(n1)NC(=O)C2
|
|
|
550
|
CCc1c2cc3c(cc2no1)OCCO3
|
|
|
551
|
Cc1cc(nc(n1)C2=[NH+]c3ncnn3[C@@H](N2)c4ccccc4)C
|
|
|
552
|
Cn1c(=O)c(nn(c1=O)C)Oc2ccc3c(c2)OCO3
|
|
|
553
|
c1ccc2c(c1)c3c([nH]2)C[C@@H]4[C@@H](C3)c5ccccc5NC4=O
|
|
|
554
|
Cc1c(cnn1c2ccccc2)c3ccnn3C(=O)c4ccco4
|
|
|
555
|
CCCSc1ccc2c(c1)[nH]c(n2)N
|
|
|
556
|
COC1CCCC2C1OC(=C(C2)C(=O)N)NC3CCCCC3
|
|
|
557
|
CC(C)c1nc2n(n1)C3(CCCCC3)[C@@H]4CCCC[C@@H]4N2
|
|
|
558
|
c1ccc2c(c1)[nH]c(=O)n2c3nc4c(o3)cccn4
|
|
|
559
|
c1cc(sc1)c2c(nc([nH]2)[C@@H]3CCC=CC3)c4cccs4
|
|
|
560
|
c1ccc2c(c1)c(n[nH]2)n3cccc3
|
|
|
561
|
CCCC(=O)NC1CCC(C2C1[C@@H]3[C@@H]2CCCCC3)O
|
|
|
562
|
Cc1cc2ncn3c4ccccc4nc3n2n1
|
|
|
563
|
c1ccc2c(c1)C(=O)C(C2=O)(c3c([nH]c(=O)[nH]c3=O)[O-])O
|
|
|
564
|
c1ccc(cc1)c2c(c(=O)c3ccccc3[nH]2)C(=O)c4ccccc4
|
|
|
565
|
CC1=NC2CCCCC2N[C@@H](C1)C3CCOC3
|
|
|
566
|
c1cc2c(cc1C3=CNC(=O)CO3)cc([nH]2)c4ccncc4
|
|
|
567
|
c1ccc2c(c1)nnn2c3ccc4nnnn4n3
|
|
|
568
|
c1ccc(cc1)[C@@H]2C[C@@H](Nc3n2ncn3)c4ccccc4O
|