0 B14R2.20 C1=CC(=CC=C1C2=CSC(=N2)N)Cl PI-30301 [0,0,0,0,0,0|0,1,2]=3 1 B14R2.20 C1=CC(=CC=C1C2=CSC(=N2)N)F PI-31543 [0,0,0,0,0,0|0,2,2]=4 2 B14R2.20 C1=CC(=CC=C1C2=CSC(=N2)N)O PI-31545 [0,0,0,0,0,0|1,1,2]=4 3 B14R2.20 C1CC(=O)OC1C2=CC=C(C=C2)F PI-11378 [0,0,0,0,0,0|3,1,0]=4 4 B14R2.20 Cc1ccc(cc1)c2csc(n2)N PI-24219 [0,0,0,0,0,0|1,1,2]=4 5 B14R2.20 Nc1nc(cs1)c2ccc(cc2)Br PI-14062 [0,0,0,0,0,0|0,2,2]=4 6 B13R2.10 C1=CC=C(C=C1)C2=NC(=NS2)N PI-11904 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.10 C1=CC=C(C=C1)C2=NSC(=N2)N PI-30216 [1,0,0,0,0,0|1,1,1]=4 8 B13R2.10 C1C(NC(=O)O1)C2=CC=CC=C2 PI-10343 [1,0,0,0,0,0|1,0,1]=3 9 B13R2.10 C1C(NC(=S)O1)C2=CC=CC=C2 PI-10344 [1,0,0,0,0,0|1,0,1]=3 10 B13R2.10 C1C(NC(=S)S1)C2=CC=CC=C2 PI-16639 [1,0,0,0,0,0|1,1,1]=4 11 B13R2.10 C1CN(N=C1N)C2=CC=CC=C2 PI-30482 [1,0,0,0,0,0|2,0,0]=3 12 B13R2.10 CC1=NC(=NO1)C2=CC=CC=C2 PI-30093 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.10 O=C1CCC(O1)c2ccccc2 PI-18042 [1,0,0,0,0,0|3,0,0]=4 14 B13R2.10 O=C1OC[C@H](N1)c2ccccc2 PI-11224 [1,0,0,0,0,0|1,0,1]=3 15 B13R2.10 S=C1OC[C@H](N1)c2ccccc2 PI-16645 [1,0,0,0,0,0|1,0,1]=3 16 B13R2.10 S=C1SC[C@H](N1)c2ccccc2 PI-16640 [1,0,0,0,0,0|1,1,1]=4 17 B13R2.12 C1=CC(=CC=C1C2=NOC=N2)N PI-48820 [1,0,0,0,0,0|2,0,1]=4 18 B13R2.12 Clc1ccc(cc1)C2CCCN2 PI-34554 [1,0,0,0,0,0|1,0,2]=4 19 B15R2.275 C1=CC(=CC=C1C2=NOC(=N2)CCl)Cl PI-20156 [0,1,0,0,0,0|2,0,1]=4 20 B15R2.309 CC1=C(N=C(S1)N)C2=CC=C(C=C2)Cl PI-31544 [0,1,0,0,0,0|0,1,2]=4 21 B15R2.1153 C1=CC(=C(C=C1Cl)Cl)C2=CSC(=N2)N PI-31554 [0,1,0,0,0,0|0,1,2]=4 22 B13R1.14 COC(=O)C=CC1=CC=C(C=C1)Cl PI-30910 [0,0,1,0,0,0|2,0,1]=4 23 B13R1.14 COC(=O)CCC1=CC=C(C=C1)O PI-11989 [0,0,1,0,0,0|3,0,0]=4 24 B13R1.132 C1=CC(=CC=C1C(CC(=O)O)N)Cl PI-30270 [0,0,1,0,0,0|3,0,0]=4 25 B15R2.98 C1C(NC(=O)O1)CC2=CC=C(C=C2)N PI-10520 [0,0,0,0,0,1|2,0,1]=4 26 B15R2.98 C1C(NC(=O)O1)CC2=CC=C(C=C2)N PI-42010 [0,0,0,0,0,1|2,0,1]=4 27 B12R1.21 OC(=O)CCc1ccc(cc1)Cl PI-11982 [1,0,1,0,0,0|2,0,0]=4 28 B12R1.107 CC(c1ccccc1)CC(=O)O PI-25588 [1,0,1,0,0,0|2,0,0]=4 29 B12R2.2 C1CC(N=C1)C2=CN=CC=C2 PI-44326 [2,0,0,0,0,0|2,0,0]=4 30 B14R1.134 COC(=O)C(CC1=CC=C(C=C1)Cl)N PI-30139 [0,1,1,0,0,0|2,0,0]=4 31 B14R1.502 CCOC(=O)\N=C\c1ccc(Cl)cc1 PI-23173 [0,1,1,0,0,0|1,0,1]=4 32 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br PI-50433 [0,0,1,0,1,0|1,1,0]=4 33 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl PI-13010 [0,0,1,0,1,0|1,0,0]=3 34 B12R1.49 COC(=O)CC1=CC=C(C=C1)F PI-50441 [0,0,1,0,1,0|1,1,0]=4 35 B12R1.49 COC(=O)CC1=CC=C(C=C1)N PI-50506 [0,0,1,0,1,0|2,0,0]=4 36 B12R1.49 COC(=O)CC1=CC=C(C=C1)O PI-11994 [0,0,1,0,1,0|2,0,0]=4 37 B12R1.49 COC(=O)Cc1ccc(cc1)C PI-12770 [0,0,1,0,1,0|2,0,0]=4 38 B12R1.20 C1=CC(=CC=C1C(C(=O)O)N)Cl PI-15413 [0,0,1,0,1,0|2,0,0]=4 39 B12R1.20 C1=CC(=CC=C1C(C(=O)O)N)Cl PI-21861 [0,0,1,0,1,0|2,0,0]=4 40 B12R1.20 C1=CC(=CC=C1C(C(=O)O)N)Cl PI-21862 [0,0,1,0,1,0|2,0,0]=4 41 B12R1.20 C1=CC(=CC=C1C(C(=O)O)O)Cl PI-11218 [0,0,1,0,1,0|2,0,0]=4 42 B12R1.20 CC(C1=CC=C(C=C1)Cl)C(=O)O PI-30984 [0,0,1,0,1,0|1,0,0]=3 43 B12R1.20 CC(c1ccc(cc1)C)C(=O)O PI-11714 [0,0,1,0,1,0|2,0,0]=4 44 B14R2.19 C1C(NC(=S)O1)CC2=CC=CC=C2 PI-16646 [1,0,0,0,0,1|1,0,1]=4 45 B14R2.19 C1C(NC(=S)O1)CC2=CC=CC=C2 PI-16647 [1,0,0,0,0,1|1,0,1]=4 46 B14R2.19 O=C1OC[C@H](CC2=CC=CC=C2)N1 PI-16270 [1,0,0,0,0,1|1,0,1]=4 47 B14R2.19 O=C1OC[C@H](N1)Cc2ccccc2 PI-10266 [1,0,0,0,0,1|1,0,1]=4