0 B13R2.57 COc1ccc2c(c1)OCCO2 CSC009884742 [0,0,0,0,0,0|2,0,2]=4 1 B13R2.57 COc1ccc2nccnc2c1 CSC000041819 [0,0,0,0,0,0|2,0,0]=2 2 B13R2.57 COc1cnc2ccccc2c1 CSC012187421 [0,0,0,0,0,0|1,0,0]=1 3 B13R2.57 CSc1ccc2ccccc2c1 CSC000000181 [0,0,0,0,0,0|0,1,0]=1 4 B13R2.57 CSc1ccc2ccccc2n1 CSC015436161 [0,0,0,0,0,0|1,1,0]=2 5 B14R2.92 COc1ccc2ccccc2c1Br CSC000173347 [0,1,0,0,0,0|0,0,0]=1 6 B14R2.112 CCOc1ccc2ncccc2c1 CSC000055991 [0,1,0,0,0,0|1,0,0]=2 7 B14R2.112 CCSc1ccc2ccccc2c1 CSC000000182 [0,1,0,0,0,0|0,1,0]=2 8 B14R2.112 CSCc1ccc2ccccc2c1 CSC000053063 [0,1,0,0,0,0|0,1,0]=2 9 B14R2.134 COc1ccc2c(c1)NC(=O)CC2 CSC012187205 [0,1,0,0,0,0|1,0,2]=4 10 B14R2.781 CS(=O)c1ccc2ccccc2c1 CSC000064364 [0,1,0,0,0,0|0,1,0]=2 11 B14R2.1019 CCc1nc2ccccc2c(=O)[nH]1 CSC011386804 [0,1,0,0,0,0|3,0,0]=4 12 B14R2.1019 CSc1nc2ccccc2c(=O)[nH]1 CSC015683295 [0,1,0,0,0,0|2,1,0]=4 13 B14R2.1801 COc1ccc2c(c1)CCCC2=O CSC000211529 [0,1,0,0,0,0|0,0,3]=4 14 B14R2.1801 COc1ccc2c(c1)CCNC2=O CSC000081304 [0,1,0,0,0,0|1,0,2]=4 15 B14R2.2332 COc1ccc2cc(ccc2c1)Br CSC000170439 [0,1,0,0,0,0|0,0,0]=1 16 B12R1.27 COC(=O)C#Cc1ccccc1 CSC011216089 [0,0,1,0,0,0|1,0,2]=4 17 B12R1.27 COC(=O)COc1ccccc1 CSC000148705 [0,0,1,0,0,0|2,0,1]=4 18 B12R1.27 COC(=O)CSc1ccccc1 CSC000151200 [0,0,1,0,0,0|2,0,1]=4 19 B12R1.27 COC(=O)NCc1ccccc1 CSC000235978 [0,0,1,0,0,0|2,0,1]=4 20 B12R1.371 COC(=O)Cc1ccccc1Br CSC000699816 [0,0,1,0,0,0|2,0,1]=4 21 B12R1.371 COC(=O)Cc1ccccc1C CSC000175439 [0,0,1,0,0,0|1,0,2]=4 22 B12R1.371 COC(=O)Cc1ccccc1F CSC000149365 [0,0,1,0,0,0|2,0,1]=4 23 B12R1.371 COC(=O)Cc1ccccc1O CSC000758901 [0,0,1,0,0,0|2,0,1]=4 24 B12R2.32 CSc1nc2ccccc2[nH]1 CSC000169833 [0,0,0,0,1,0|2,1,0]=4 25 B12R2.32 CSc1nc2ccccc2o1 CSC000000691 [0,0,0,0,1,0|2,1,0]=4 26 B12R2.32 CSc1nc2ccccc2s1 CSC000000696 [0,0,0,0,1,0|2,1,0]=4 27 B12R2.44 COc1ccc2c(c1)OCO2 CSC000005814 [0,0,0,0,1,0|2,0,1]=4 28 B11R1.91 CC(=C)COc1ccccc1 CSC000171512 [1,0,1,0,0,0|1,0,1]=4 29 B11R1.91 CC(=C)CSc1ccccc1 CSC000006268 [1,0,1,0,0,0|1,0,1]=4 30 B11R1.1 Cc1ccc(cc1)OCC=C CSC000172063 [1,0,1,0,0,0|1,0,1]=4 31 B11R1.1 Cc1ccc(cc1)SCC=C CSC000006760 [1,0,1,0,0,0|1,0,1]=4 32 B11R1.40 COC(=O)Oc1ccccc1 CSC000020726 [1,0,1,0,0,0|2,0,0]=4 33 B13R2.32 Cn1ncc2ccccc2c1=O CSC015946782 [1,1,0,0,0,0|2,0,0]=4 34 B13R2.449 CCOc1ccc2[nH]ccc2c1 CSC012017212 [0,1,0,0,1,0|1,0,0]=3 35 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 CSC011996518 [0,1,0,0,1,0|1,0,1]=4 36 B15R2.352 CCCOc1ccc2ccccc2c1 CSC000005839 [0,2,0,0,0,0|0,0,0]=2 37 B15R2.352 CCCSc1ccc2ccccc2c1 CSC048195454 [0,2,0,0,0,0|0,1,0]=3 38 B15R2.352 N#CCSc1ccc2ccccc2c1 CSC000148427 [0,2,0,0,0,0|0,1,0]=3 39 B15R2.352 OCCOc1ccc2ccccc2c1 CSC011219602 [0,2,0,0,0,0|0,0,0]=2 40 B15R2.352 OCCSc1ccc2ccccc2c1 CSC000193269 [0,2,0,0,0,0|0,1,0]=3 41 B15R2.1282 CCOc1ccc2ccc(=O)oc2c1 CSC000005965 [0,2,0,0,0,0|1,0,0]=3 42 B15R2.1601 COC(=O)c1ccc2ccccc2n1 CSC000150341 [0,2,0,0,0,0|1,0,0]=3 43 B15R2.1601 COC(=O)c1ccc2cnccc2n1 CSC000040510 [0,2,0,0,0,0|2,0,0]=4 44 B15R2.1601 COC(=O)c1ccc2ncccc2c1 CSC011217999 [0,2,0,0,0,0|1,0,0]=3 45 B15R2.1601 COC(=O)c1ccc2nccnc2c1 CSC000148277 [0,2,0,0,0,0|2,0,0]=4 46 B15R2.1601 COC(=O)c1cnc2ccccc2n1 CSC000193719 [0,2,0,0,0,0|2,0,0]=4 47 B15R2.1601 NNC(=O)c1ccc2ccccc2c1 CSC000189791 [0,2,0,0,0,0|2,0,0]=4 48 B15R2.1668 CC(=O)Nc1ccc2ccccc2c1 CSC000154015 [0,2,0,0,0,0|1,0,0]=3 49 B15R2.1668 CC(=O)Nc1ccc2ncccc2c1 CSC000185984 [0,2,0,0,0,0|2,0,0]=4 50 B15R2.1668 CC(=O)Nc1cnc2ccccc2c1 CSC011195435 [0,2,0,0,0,0|2,0,0]=4 51 B15R2.1668 CC(=O)Nc1cnc2ccccc2c1 CSC011195435 [0,2,0,0,0,0|2,0,0]=4 52 B15R2.1668 CC(=O)Oc1ccc2ccccc2c1 CSC000002291 [0,2,0,0,0,0|0,0,0]=2 53 B15R2.1668 CC(=O)Oc1ccc2nccnc2c1 CSC015473003 [0,2,0,0,0,0|2,0,0]=4 54 B15R2.1668 CC(C)Sc1ccc2ccccc2c1 CSC048362076 [0,2,0,0,0,0|0,1,0]=3 55 B15R2.1668 NC(=O)Cc1ccc2ccccc2c1 CSC000162105 [0,2,0,0,0,0|1,0,1]=4 56 B15R2.1668 NC(=O)Nc1ccc2ccccc2c1 CSC000239035 [0,2,0,0,0,0|1,0,1]=4 57 B15R2.10252 CCOc1ccc2cc(ccc2c1)Br CSC000170440 [0,2,0,0,0,0|0,0,0]=2 58 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C CSC000005868 [0,2,0,0,0,0|1,0,0]=3 59 B15R2.4441 CS(=O)(=O)c1ccc2ccccc2c1 CSC000048121 [0,2,0,0,0,0|0,1,0]=3 60 B15R2.7180 NC(=O)c1ccc2cc(ccc2c1)Br CSC012348387 [0,2,0,0,0,0|2,0,0]=4 61 B11R1.25 COC(=O)C=Cc1cccs1 CSC000004362 [0,0,1,0,1,0|2,0,0]=4 62 B11R1.222 COC(=O)c1ccccc1Cl CSC000150121 [0,0,1,0,1,0|2,0,0]=4 63 B11R1.222 COC(=O)c1ccccc1I CSC000148710 [0,0,1,0,1,0|2,0,0]=4