0 B13R1.42 C\C=C\C(=O)OCC1=CC=CC=C1 CS-0046880 [0,0,0,0,0,0|2,0,2]=4 1 B12R1.27 COC(=O)C#CC1=CC=CC=N1 CS-0036606 [1,0,0,0,0,0|1,0,2]=4 2 B12R1.27 NCC(=O)OCC1=CC=CC=C1 CS-W005117 [1,0,0,0,0,0|2,0,1]=4 3 B12R1.27 O=C(CBr)CCC1=CC=CC=C1 CS-W019479 [1,0,0,0,0,0|1,0,2]=4 4 B14R1.32 CCOC(=O)\C=C\C1=CC(O)=CC=C1 CS-0047066 [0,1,0,0,0,0|0,0,0]=1 5 B14R1.60 CCOC(=O)C(=O)CC1=NC=CN=C1 CS-0044465 [0,1,0,0,0,0|2,0,1]=4 6 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 CS-W018907 [0,1,0,0,0,0|2,0,1]=4 7 B14R1.156 O=C(CCCO)OCC1=CC=CC=C1 CS-0047314 [0,1,0,0,0,0|2,0,1]=4 8 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Br)C=C1 CS-W021127 [0,1,0,0,0,0|0,0,0]=1 9 B14R1.598 CCOC(=O)\C=C\C1=CC=CC=C1F CS-0046904 [0,1,0,0,0,0|0,0,0]=1 10 B14R2.112 CNCC1=CC=C2C=CC=CC2=C1 CS-0045366 [0,0,0,1,0,0|3,0,0]=4 11 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1C2=CC=CC=C2 CS-0059145 [0,0,0,1,0,0|2,0,1]=4 12 B12R1.32 CCOC(=O)CC1=NC=CC=C1 CS-0020135 [0,0,0,0,1,0|1,0,1]=3 13 B12R1.32 O=C(CCBr)NC1=CC=CC=C1 CS-0079928 [0,0,0,0,1,0|3,0,0]=4 14 B14R1.520 CCOC(=O)\C=C\CC1=CC=CC=C1 CS-0047024 [0,0,0,0,0,1|0,0,0]=1 15 B11R1.91 O=C(O)\C=C\C1=CC=NC=C1 CS-W021781 [2,0,0,0,0,0|1,0,0]=3 16 B11R1.91 O=C(O)\C=C\C1=NC=CC=C1 CS-W021780 [2,0,0,0,0,0|1,0,0]=3 17 B13R1.11 COC(=O)CC(=O)C1=CC=CC=C1 CS-0019251 [1,1,0,0,0,0|0,0,1]=3 18 B13R1.11 COC(=O)CC(=O)C1=CC=NC=C1 CS-0037567 [1,1,0,0,0,0|1,0,1]=4 19 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 CS-0031374 [1,1,0,0,0,0|0,0,2]=4 20 B13R1.14 COC(=O)\C=C\C1=CC=C(O)C=C1 CS-W020031 [1,1,0,0,0,0|0,0,0]=2 21 B13R1.15 COC(=O)\C=C\C1=CC(C)=CC=C1 CS-0046959 [1,1,0,0,0,0|0,0,0]=2 22 B13R1.15 COC(=O)\C=C\C1=CC(Cl)=CC=C1 CS-0035693 [1,1,0,0,0,0|0,0,0]=2 23 B13R1.15 COC(=O)\C=C\C1=CC(N)=CC=C1 CS-0036729 [1,1,0,0,0,0|0,0,0]=2 24 B13R1.351 C[C@@H](O)C(=O)OCC1=CC=CC=C1 CS-0115191 [1,1,0,0,0,0|1,0,1]=4 25 B13R1.351 C[C@H](N)C(=O)OCC1=CC=CC=C1 CS-W011863 [1,1,0,0,0,0|1,0,1]=4 26 B13R1.528 COC(=O)\C=C\C1=CC=CC=C1N CS-0102068 [1,1,0,0,0,0|0,0,0]=2 27 B13R1.19 CCOC(=O)CC1=CC=C(Br)C=N1 CS-0049532 [0,1,0,0,1,0|1,0,1]=4 28 B13R1.20 CCOC(=O)CC1=CC(Br)=NC=C1 CS-B0980 [0,1,0,0,1,0|1,0,1]=4 29 B13R1.20 CCOC(=O)CC1=NC(Cl)=CC=C1 CS-0042620 [0,1,0,0,1,0|1,0,1]=4 30 B13R1.20 CCOC(=O)CC1=NC=CC(Br)=C1 CS-W020454 [0,1,0,0,1,0|1,0,1]=4 31 B13R1.470 CCOC(=O)CC1=C(Br)C=NC=C1 CS-B0995 [0,1,0,0,1,0|1,0,1]=4 32 B13R1.470 CCOC(=O)CC1=CC=CC=C1I CS-0041136 [0,1,0,0,1,0|0,0,1]=3 33 B13R1.33 CCOC(=O)CC(=O)C1=CSC=C1 CS-0042835 [0,1,0,0,1,0|1,0,1]=4 34 B13R1.41 CCOC(=O)\C=C\C1=CN(C)N=C1 CS-0046910 [0,1,0,0,1,0|2,0,0]=4 35 B15R1.89 CCOC(=O)\C=N/[C@H](C)C1=CC=CC=C1 CS-0009254 [0,1,0,0,0,1|0,0,1]=3 36 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 CS-W018590 [0,1,0,0,0,1|0,0,1]=3 37 B15R1.24 CCOC(=O)CC(=O)C1=CC(F)=CC=C1 CS-W015120 [0,2,0,0,0,0|0,0,1]=3 38 B15R1.24 CCOC(=O)CC(=O)C1=CC=CC(C)=C1 CS-W005940 [0,2,0,0,0,0|0,0,1]=3 39 B15R1.10390 CCOC(=O)\C=C\C1=CC(F)=C(Br)C=C1 CS-0037613 [0,2,0,0,0,0|0,0,0]=2 40 B15R1.48 CCOC(=O)C(=O)NC1=CC=C(Cl)C=C1 CS-M1142 [0,2,0,0,0,0|1,0,0]=3 41 B15R1.640 CCOC(=O)C(C#N)CC1=CC=CC=C1 CS-0038810 [0,2,0,0,0,0|0,0,2]=4 42 B15R1.640 CCOC(=O)\C(C#N)=C\C1=CC=CC=N1 CS-0036783 [0,2,0,0,0,0|1,0,0]=3 43 B15R1.5919 O=C(O)CNC(=O)\C=C\C1=CC=CC=C1 CS-M1704 [0,2,0,0,0,0|1,0,1]=4 44 B15R1.791 CCOC(=O)CCC1=CC=C(O)C=C1C CS-M0678 [0,2,0,0,0,0|0,0,2]=4 45 B15R1.3465 CC(C)(C)OC(=O)\C=C\C1=CC=CC=N1 CS-0039016 [0,2,0,0,0,0|1,0,0]=3 46 B13R1.464 CCOC(=O)C1=CC=CC=C1NO CS-0100268 [0,0,1,1,0,0|2,0,0]=4 47 B13R1.460 CCOC(=O)C1=CC=CC(C=O)=N1 CS-0035545 [0,0,1,1,0,0|2,0,0]=4 48 B13R2.10 O=C1N=C(C2=CC=CC=C2)NO1 CS-0043875 [1,0,0,1,0,0|2,0,0]=4 49 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 CS-W023164 [1,0,0,1,0,0|1,0,0]=3 50 B13R2.33 O=C1CCC2=CC=CC=C2CC1 CS-W020691 [1,0,0,1,0,0|0,0,2]=4 51 B13R2.57 BrCC1=NC2=CC=CC=C2C=C1 CS-W014727 [1,0,0,1,0,0|2,0,0]=4 52 B13R2.57 NCC1=CC=C2C=CC=CC2=C1 CS-W018759 [1,0,0,1,0,0|2,0,0]=4 53 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 CS-0044957 [1,0,0,1,0,0|2,0,0]=4 54 B15R2.73 CCOC(=O)C1=C2C=NC=CN2C=N1 CS-0049395 [0,0,0,1,0,1|2,0,0]=4 55 B15R2.73 CCOC(=O)C1=CN=C2C=CC=CN12 CS-0043129 [0,0,0,1,0,1|1,0,0]=3 56 B15R2.73 CCOC(=O)C1=NC=C2C=CC=CN21 CS-W022717 [0,0,0,1,0,1|1,0,0]=3 57 B15R2.73 CCOC(=O)C1=NNC2=C1C=CC=C2 CS-0006067 [0,0,0,1,0,1|1,0,0]=3 58 B15R2.73 CCOC(=O)C1=NOC2=C1C=CC=C2 CS-W006634 [0,0,0,1,0,1|1,0,0]=3 59 B15R2.1356 CCOC(=O)C1=CC2=CC=CN=C2N1 CS-B1286 [0,1,0,1,0,0|1,0,0]=3 60 B15R2.1356 CCOC(=O)C1=NC2=CC=CC=C2S1 CS-W015265 [0,1,0,1,0,0|1,0,0]=3 61 B15R2.1356 CCOC(=O)C1=NN2C=CC=NC2=C1 CS-0038296 [0,1,0,1,0,0|2,0,0]=4 62 B15R2.2115 COC1=C2C=CC=CC2=CC=C1C=O CS-0061935 [0,1,0,1,0,0|2,0,0]=4 63 B11R1.40 COC(=O)CC1=CC=CN=C1 CS-0037030 [1,0,0,0,1,0|1,0,1]=4 64 B11R1.16 O=C(OCCl)C1=CC=CC=C1 CS-W004798 [0,0,0,0,2,0|1,0,0]=3