0  B15R2.61364  CC1(CC(=O)c2c(ncnc2C1)N)C Molport-001-674-668 [0,0,0,0,0,0|0,0,0]=0
1  B16R2.392063  Cc1cc(=O)c2c(o1)CC(CC2=O)(C)C Molport-001-943-774 [0,1,0,0,0,0|3,0,0]=4
2  B16R2.392063  Cc1cc(=O)oc2c1C(=O)CC(C2)(C)C Molport-002-915-338 [0,1,0,0,0,0|3,0,0]=4
3  B16R2.392063  Cc1cc(c2c(n1)CC(CC2=O)(C)C)C Molport-002-910-377 [0,1,0,0,0,0|2,0,0]=3
4  B16R2.392063  Cc1nc(nc2c1C(=O)CC(C2)(C)C)N Molport-001-025-257 [0,1,0,0,0,0|1,0,0]=2
5  B14R1.19481  C/C(=N\O)/C1=C(CC(CC1=O)(C)C)O Molport-000-474-228 [0,0,1,0,0,0|3,0,0]=4
6  B14R2.24368  CC1(Cc2[nH]nc(c2C(=O)C1)N)C Molport-030-041-201 [0,0,0,0,1,0|0,0,1]=2
7  B14R2.24368  Cc1[nH]nc2c1C(=O)CC(C2)(C)C Molport-003-808-853 [0,0,0,0,1,0|1,0,1]=3
8  B14R2.24368  Cc1c[nH]c2c1C(=O)CC(C2)(C)C Molport-019-878-560 [0,0,0,0,1,0|1,0,1]=3
9  B14R2.24368  Cc1n[nH]c2c1C(=O)CC(C2)(C)C Molport-000-478-274 [0,0,0,0,1,0|1,0,1]=3
10  B13R1.8379  CC(=C1C(=O)CC(CC1=O)(C)C)N Molport-001-833-113 [1,0,1,0,0,0|1,0,1]=4
11  B13R1.8379  CC1(CC(=O)C(=C(N)N)C(=O)C1)C Molport-000-184-172 [1,0,1,0,0,0|1,0,1]=4
12  B15R2.65793  CC1CC(=O)c2c(nc(nc2C1)N)C Molport-002-040-092 [1,1,0,0,0,0|1,0,0]=3
13  B15R2.63911  CC1(CC(=O)c2cnc(nc2C1)N)C Molport-000-886-243 [1,1,0,0,0,0|0,0,0]=2
14  B15R2.63911  CC1(CC(=O)c2cnc(nc2C1)[S-])C Molport-042-600-752 [1,1,0,0,0,0|0,0,0]=2
15  B15R2.63911  Cc1ccc2c(n1)CC(CC2=O)(C)C Molport-003-806-180 [1,1,0,0,0,0|1,0,0]=3
16  B15R2.91551  CCc1n[nH]c2c1C(=O)CC(C2)(C)C Molport-001-900-962 [0,1,0,0,1,0|1,0,1]=4
17  B15R2.91551  CSc1scc2c1C(=O)CC(C2)(C)C Molport-002-906-349 [0,1,0,0,1,0|2,0,0]=4
18  B15R2.155263  Cc1[nH]c2c(c1C)C(=O)CC(C2)(C)C Molport-009-756-958 [0,1,0,0,1,0|1,0,1]=4
19  B17R2.1211306  CCc1nc(nc2c1C(=O)CC(C2)(C)C)N Molport-001-619-046 [0,2,0,0,0,0|1,0,0]=3
20  B13R1.3561  CC(C)(C)OC(=O)n1ccnc1N Molport-030-005-346 [0,0,1,0,1,0|2,0,0]=4
21  B13R2.3736  CC1(COc2c(cnn2C1)N)C Molport-035-775-624 [1,0,0,0,1,0|2,0,0]=4
22  B13R2.3736  CC1(COc2c(cnn2C1)N)C Molport-051-780-820 [1,0,0,0,1,0|2,0,0]=4
23  B13R2.5232  CC1(Cc2[nH]ccc2C(=O)C1)C Molport-003-661-494 [1,0,0,0,1,0|0,0,1]=3
24  B13R2.5232  CC1(Cc2[nH]cnc2C(=O)C1)C Molport-006-199-822 [1,0,0,0,1,0|0,0,1]=3
25  B13R2.5232  CC1(Cc2[nH]ncc2C(=O)C1)C Molport-006-734-818 [1,0,0,0,1,0|0,0,1]=3
26  B13R2.5232  CC1(Cc2occc2C(=O)C1)C Molport-000-263-273 [1,0,0,0,1,0|1,0,0]=3