0 B14R1.156 O=C(NCCBr)OCC1=CC=CC=C1 12356 [0,0,0,0,0,0|3,0,1]=4 1 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 29017 [1,0,0,0,0,0|0,0,2]=3 2 B13R1.42 CCOC(=O)COC1=CC=CC=C1 12485 [1,0,0,0,0,0|1,0,1]=3 3 B13R1.42 CCOC(=O)COC1=CC=CN=C1 16756 [1,0,0,0,0,0|2,0,1]=4 4 B13R1.42 CCOC(=O)CSC1=CC=CC=C1 10853 [1,0,0,0,0,0|1,0,1]=3 5 B13R1.42 CCOC(=O)\C=C\C1=CC=NC=C1 20165 [1,0,0,0,0,0|1,0,0]=2 6 B13R1.42 NCCC(=O)OCC1=CC=CC=C1 12070 [1,0,0,0,0,0|2,0,1]=4 7 B15R2.38 O=C1CCCC\C1=C\C2=CC=CC=C2 14548 [0,0,0,1,0,0|1,0,0]=2 8 B13R1.44 CCOCC(=O)NC1=CC=CC=C1 3367 [0,0,0,0,1,0|3,0,0]=4 9 B12R1.27 COC(=O)CCC1=CC=CC=C1 18417 [2,0,0,0,0,0|0,0,2]=4 10 B12R1.27 COC(=O)COC1=CC=CC=C1 12489 [2,0,0,0,0,0|1,0,1]=4 11 B12R1.27 COC(=O)CSC1=CC=CC=C1 10851 [2,0,0,0,0,0|1,0,1]=4 12 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 8189 [2,0,0,0,0,0|0,0,0]=2 13 B14R1.29 CCOC(=O)CC(=O)C1=CC=CC=C1 20129 [1,1,0,0,0,0|0,0,1]=3 14 B14R1.29 CCOC(=O)CC(=O)C1=NC=CC=C1 11088 [1,1,0,0,0,0|1,0,1]=4 15 B14R1.29 CCOC(=O)CC(N)C1=CC=CC=C1 13894 [1,1,0,0,0,0|0,0,2]=4 16 B14R1.29 CCOC(=O)C[C@@H](N)C1=CC=CC=C1 13851 [1,1,0,0,0,0|0,0,2]=4 17 B14R1.29 CCOC(=O)C[C@H](N)C1=CC=CC=C1 13852 [1,1,0,0,0,0|0,0,2]=4 18 B14R1.29 CCOC(=O)C[C@H](O)C1=CC=CC=C1 23251 [1,1,0,0,0,0|0,0,2]=4 19 B14R1.29 CCOC(=O)\C=C(/C)C1=CC=CC=C1 31859 [1,1,0,0,0,0|0,0,0]=2 20 B14R1.32 CCOC(=O)\C=C\C1=CC(Cl)=NC=C1 16688 [1,1,0,0,0,0|1,0,0]=3 21 B14R1.32 CCOC(=O)\C=C\C1=CC(N)=CC=C1 13751 [1,1,0,0,0,0|0,0,0]=2 22 B14R1.60 CCOC(=O)[C@@H](N)CC1=CC=CC=C1 19008 [1,1,0,0,0,0|0,0,2]=4 23 B14R1.502 CCOC(=O)C#CC1=CC=C(Cl)C=C1 12614 [1,1,0,0,0,0|0,0,2]=4 24 B14R1.502 CCOC(=O)CCC1=CC=C(N)C=C1 27582 [1,1,0,0,0,0|0,0,2]=4 25 B14R1.502 CCOC(=O)CCC1=CC=C(O)C=C1 20092 [1,1,0,0,0,0|0,0,2]=4 26 B14R1.502 CCOC(=O)\C=C\C1=CC=C(C)C=C1 8180 [1,1,0,0,0,0|0,0,0]=2 27 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Cl)C=C1 8172 [1,1,0,0,0,0|0,0,0]=2 28 B14R1.502 CCOC(=O)\C=C\C1=CC=C(Cl)N=C1 26764 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)C=C1 8158 [1,1,0,0,0,0|0,0,0]=2 30 B14R1.502 CCOC(=O)\C=C\C1=CC=C(N)N=C1 26763 [1,1,0,0,0,0|1,0,0]=3 31 B14R1.502 CCOC(=O)\C=N\C1=CC=C(Br)C=C1 22847 [1,1,0,0,0,0|1,0,0]=3 32 B14R1.598 CCOC(=O)COC1=C(O)C=CC=C1 34170 [1,1,0,0,0,0|1,0,1]=4 33 B14R1.598 CCOC(=O)\C=C\C1=C(Br)C=CC=C1 16216 [1,1,0,0,0,0|0,0,0]=2 34 B14R1.598 CCOC(=O)\C=C\C1=CC=CN=C1Cl 16540 [1,1,0,0,0,0|1,0,0]=3 35 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 9386 [1,0,0,1,0,0|2,0,0]=4 36 B14R2.7150 CNCC1=CC=CC2=CC=CC=C21 9387 [1,0,0,1,0,0|2,0,0]=4 37 B14R2.7150 OCCc1cccc2ccccc12 9362 [1,0,0,1,0,0|2,0,0]=4 38 B14R2.112 OCCC1=CC2=CC=CC=C2C=C1 25691 [1,0,0,1,0,0|2,0,0]=4 39 B14R2.112 OCCc1ccc2ccccc2c1 9427 [1,0,0,1,0,0|2,0,0]=4 40 B14R2.598 O=C1C=C(C2=CC=CC=C2)C(=O)O1 26369 [1,0,0,1,0,0|1,0,1]=4 41 B14R2.67 CCCCC1=CC2=C(C=CC=C2)O1 35334 [0,0,0,1,1,0|1,0,1]=4 42 B14R2.67 CCCCC1=CC2=CC=CC=C2C1 5387 [0,0,0,1,1,0|2,0,0]=4 43 B16R2.3896 O=C1CCCCC1C(=O)C2=CC=CC=C2 34550 [0,1,0,1,0,0|1,0,1]=4 44 B12R1.32 CCOC(=O)CC1=CC=CC=C1 15902 [1,0,0,0,1,0|0,0,1]=3 45 B12R1.32 CCOC(=O)CC1=CC=CN=C1 20506 [1,0,0,0,1,0|1,0,1]=4 46 B12R1.32 CCOC(=O)CC1=CC=NC=C1 12839 [1,0,0,0,1,0|1,0,1]=4 47 B12R1.32 NCCC(=O)NC1=CC=CC=C1 21788 [1,0,0,0,1,0|2,0,0]=4 48 B12R1.32 NCCC(=O)NC1=CC=CC=C1 21789 [1,0,0,0,1,0|2,0,0]=4 49 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 13915 [1,0,0,0,1,0|2,0,0]=4 50 B12R1.30 CCCCC(=O)C1=CC=CC=C1 25461 [0,0,0,0,2,0|1,0,0]=3 51 B12R1.30 CNCCC(=O)C1=CC=CC=C1 20705 [0,0,0,0,2,0|2,0,0]=4 52 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 19864 [0,0,0,0,2,0|1,0,0]=3