0 B14R2.8235 CC1CC(=O)C2=C(C=CC(F)=C2)O1 2064AF [0,0,0,0,0,0|2,0,2]=4 1 B13R2.162 CC1=CC2=C(C=C1)CCCC2=O 6492AJ [1,0,0,0,0,0|1,0,2]=4 2 B13R2.162 CC1=CC2=C(C=C1)OCCC2=O 5174AB [1,0,0,0,0,0|1,0,2]=4 3 B13R2.162 CC1=CC2=C(C=C1)OCCC2N 9773AB [1,0,0,0,0,0|2,0,0]=3 4 B13R2.162 NC1=CC=C2CCCC(O)C2=C1 6471AJ [1,0,0,0,0,0|2,0,0]=3 5 B13R2.162 NC1CCCC2=CC=C(Br)C=C21 3656AJ [1,0,0,0,0,0|3,0,0]=4 6 B13R2.162 O=C1CCNC2=CC=C(Cl)C=C12 0995AB [1,0,0,0,0,0|1,0,2]=4 7 B13R2.3683 CC1=CC2=C(C=C1)NC(=O)CS2 6889AL [1,0,0,0,0,0|2,0,1]=4 8 B13R2.3683 NC1=CC2=C(C=C1)NC(=O)CC2 Z4435 [1,0,0,0,0,0|2,0,1]=4 9 B15R2.50278 CC1CC(C)(C)NC2=C1C=C(O)C=C2 6784AE [0,1,0,0,0,0|2,0,0]=3 10 B13R1.51 CC1=CC=C(OC(C)C)C(C=O)=C1 Z0730 [0,0,1,0,0,0|1,0,2]=4 11 B13R1.141 CCOC1=CC=C(C)C=C1B(O)O V1904 [0,0,1,0,0,0|3,0,0]=4 12 B12R1.75 CC(=O)NC1=C(CO)C=CC=C1 5403AJ [1,0,1,0,0,0|1,0,1]=4 13 B12R1.233 CC(=O)NC1=C(C)C=C(C)C=C1 6935AD [1,0,1,0,0,0|1,0,1]=4 14 B12R1.374 CCCOC1=CC(C)=CC=C1F Z9546 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.46 CCC1=C(C(C)C)C=C(N)C=C1 6398AD [1,0,1,0,0,0|2,0,0]=4 16 B12R1.226 CC1=CC=CC(OCC(C)O)=C1 4284AL [1,0,1,0,0,0|2,0,0]=4 17 B12R2.24 BrC1=CC2=C(C=C1)NCCC2 W4577 [2,0,0,0,0,0|1,0,0]=3 18 B12R2.24 BrC1=CC=C2NCCOC2=C1 X9901 [2,0,0,0,0,0|2,0,0]=4 19 B12R2.24 CC1=CC2=C(C=C1)CCNC2 W4357 [2,0,0,0,0,0|2,0,0]=4 20 B12R2.24 CC1=CC=C2CNCCC2=C1 6012AH [2,0,0,0,0,0|2,0,0]=4 21 B12R2.24 CC1=CC=C2NCCOC2=C1 V7446 [2,0,0,0,0,0|1,0,0]=3 22 B12R2.24 CC1CNC2=C(C=CC=C2)S1 6248AE [2,0,0,0,0,0|2,0,0]=4 23 B12R2.24 CC1CNC2=CC=CC=C2N1 1064AQ [2,0,0,0,0,0|1,0,0]=3 24 B12R2.24 ClC1=CC=C2NCCOC2=C1 X9067 [2,0,0,0,0,0|2,0,0]=4 25 B12R2.24 FC1=CC2=C(C=C1)NCCO2 5699AE [2,0,0,0,0,0|2,0,0]=4 26 B12R2.24 NC1=CC=C2CCCCC2=C1 X6988 [2,0,0,0,0,0|2,0,0]=4 27 B12R2.1081 CC1CCNC2=C1C=CC=C2 0022AB [2,0,0,0,0,0|1,0,0]=3 28 B12R2.1081 CC1CCNC2=C1C=CC=C2 Z5091 [2,0,0,0,0,0|1,0,0]=3 29 B12R2.1081 CN1CCNC2=C1C=CC=C2 X9648 [2,0,0,0,0,0|2,0,0]=4 30 B12R2.1081 NC1CCOC2=C1C=CC=C2 W6827 [2,0,0,0,0,0|2,0,0]=4 31 B12R2.1081 NC1CCOC2=CC=CC=C21 5088AC [2,0,0,0,0,0|2,0,0]=4 32 B12R2.1081 N[C@@H]1CCOC2=CC=CC=C21 0758AB [2,0,0,0,0,0|2,0,0]=4 33 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 B573 [2,0,0,0,0,0|2,0,0]=4 34 B12R2.1081 O=C1CCNC2=C1C=CC=C2 W8031 [2,0,0,0,0,0|0,0,2]=4 35 B12R2.1081 O[C@H]1CCCC2=C1C=CC=C2 V1329 [2,0,0,0,0,0|1,0,0]=3 36 B14R1.101 CC(C)OC1=CC=C(C=O)C=C1CO 5229AH [0,1,1,0,0,0|1,0,1]=4 37 B14R1.6074 CC1=CC=C(OC(C)C)C(B(O)O)=C1 V1846 [0,1,1,0,0,0|2,0,0]=4 38 B12R1.16 CC1=CC=C(C(N)CCO)C=C1 Z3667 [0,0,1,0,1,0|1,0,0]=3 39 B12R1.16 CC1=CC=C(N(C)CCO)C=C1 2784AB [0,0,1,0,1,0|1,0,0]=3 40 B12R1.16 NC(CCO)C1=CC=C(F)C=C1 W7350 [0,0,1,0,1,0|2,0,0]=4 41 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 W9123 [0,0,1,0,1,0|2,0,0]=4 42 B12R1.225 C[C@H](N)[C@H](O)C1=CC=CC(O)=C1 E767 [0,0,1,0,1,0|1,0,0]=3 43 B12R2.18 CC1NC2=C(C=CC=C2)C1C 1212AB [1,0,0,0,1,0|1,0,0]=3 44 B12R2.18 OC1C2=C(C=CC=C2)CC1Br 7739AB [1,0,0,0,1,0|2,0,0]=4 45 B12R2.18 OC1CC2=C(C=CC=C2)C1O 4451AL [1,0,0,0,1,0|2,0,0]=4 46 B12R2.2028 CC1CC(=O)C2=C1C=CC=C2 9076AB [1,0,0,0,1,0|0,0,2]=4 47 B12R2.606 CC1=CC2=C(C=C1)NC(=O)C2 W5647 [1,0,0,0,1,0|1,0,1]=4 48 B12R2.606 CC1CC2=C(C=CC(F)=C2)N1 2765AC [1,0,0,0,1,0|1,0,0]=3 49 B12R2.612 NC1CCC2=CC(Br)=CC=C21 3110AJ [1,0,0,0,1,0|2,0,0]=4