0 B14R2.29365 Cc1cc(c2ccc(cc2n1)F)O 271570a_203496583355_100011290880 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.29365 Cc1cc(c2ccc(nc2n1)O)C 271570a_203496583355_200000075399 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.29365 Cc1cc(nc2c1ccc(c2)N)O 271570a_203496583355_100000103534 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.29365 Cc1cc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100010883700 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.29365 Cc1ccc2c(nc(nc2c1)C)O 271570a_203496583355_200010384746 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.29365 Cc1nc(c2ccc(cc2n1)F)O 271570a_203496583355_100012003523 [0,0,0,0,0,0|4,0,0]=4 6 B14R2.29365 Cc1nc2cc(ccc2c(=O)[nH]1)O 271570a_203496583355_100012357626 [0,0,0,0,0,0|3,0,1]=4 7 B14R2.29365 Nc1cc(c2ncc(cc2c1)O)F 271570a_203496583355_100010780968 [0,0,0,0,0,0|4,0,0]=4 8 B14R2.29365 Nc1nc(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100010077259 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.29365 Nc1nc(c2ccc(cc2n1)O)N 271570a_203496583355_100012355061 [0,0,0,0,0,0|4,0,0]=4 10 B14R2.29365 O=c1[nH]c(=O)c2ccc(cc2[nH]1)O 271570a_203496583355_100012351534 [0,0,0,0,0,0|2,0,1]=3 11 B14R2.29365 O=c1[nH]c(=O)c2ccc(nc2[nH]1)O 271570a_203496583355_100000117996 [0,0,0,0,0,0|3,0,1]=4 12 B14R2.29365 O=c1[nH]c2cc(ccc2c(=O)o1)O 271570a_203496583355_100000723304 [0,0,0,0,0,0|2,0,1]=3 13 B14R2.29365 O=c1cc(c2ccc(cc2o1)O)O 271570a_203496583355_100010062223 [0,0,0,0,0,0|0,0,0]=0 14 B14R2.29365 Oc1cnc2c(nc(nc2c1)O)O 271570a_203496583355_100020641529 [0,0,0,0,0,0|3,0,1]=4 15 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [1,0,0,0,0,0|2,0,0]=3 16 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [1,0,0,0,0,0|3,0,0]=4 17 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [1,0,0,0,0,0|3,0,0]=4 18 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [1,0,0,0,0,0|3,0,0]=4 19 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [1,0,0,0,0,0|3,0,0]=4 20 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [1,0,0,0,0,0|2,0,0]=3 21 B13R2.155 Nc1ccc2ccc(cc2n1)O 271570a_203496583355_100010187616 [1,0,0,0,0,0|2,0,0]=3 22 B13R2.155 Nc1ccc2ccc(nc2n1)O 271570a_203496583355_100000117679 [1,0,0,0,0,0|3,0,0]=4 23 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [1,0,0,0,0,0|3,0,0]=4 24 B13R2.155 Nc1cnc2ccc(cc2n1)O 271570a_203496583355_100010090528 [1,0,0,0,0,0|3,0,0]=4 25 B13R2.155 Nc1ncc2ccc(cc2n1)O 271570a_203496583355_100010199760 [1,0,0,0,0,0|3,0,0]=4 26 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [1,0,0,0,0,0|1,0,2]=4 27 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [1,0,0,0,0,0|1,0,2]=4 28 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [1,0,0,0,0,0|2,0,1]=4 29 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [1,0,0,0,0,0|2,0,1]=4 30 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [1,0,0,0,0,0|2,0,1]=4 31 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [1,0,0,0,0,0|2,0,1]=4 32 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [1,0,0,0,0,0|0,0,0]=1 33 B13R2.155 O=c1ccc2cnc(cc2[nH]1)O 271570a_203496583355_100010563892 [1,0,0,0,0,0|2,0,0]=3 34 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [1,0,0,0,0,0|3,0,0]=4 35 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [1,0,0,0,0,0|1,0,1]=3 36 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [1,0,0,0,0,0|1,0,1]=3 37 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [1,0,0,0,0,0|1,0,1]=3 38 B13R2.155 Oc1ccc2ccc(nc2n1)O 271570a_203496583355_200010218124 [1,0,0,0,0,0|2,0,1]=4 39 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [1,0,0,0,0,0|3,0,0]=4 40 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [1,0,0,0,0,0|2,0,1]=4 41 B13R2.155 Oc1ccc2ncc(cc2c1)Br 271570a_203496583355_200010254249 [1,0,0,0,0,0|3,0,0]=4 42 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [1,0,0,0,0,0|2,0,1]=4 43 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [1,0,0,0,0,0|2,0,1]=4 44 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [1,0,0,0,0,0|2,0,1]=4 45 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [1,0,0,0,0,0|2,0,1]=4 46 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [1,0,0,0,0,0|3,0,0]=4 47 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [1,0,0,0,0,0|3,0,0]=4 48 B13R2.155 Oc1cnc2ccc(nc2c1)O 271570a_203496583355_100010009477 [1,0,0,0,0,0|2,0,1]=4 49 B13R2.155 [O-][n+]1ccc2ccc(cc2c1)O 271570a_203496583355_100009816120 [1,0,0,0,0,0|2,0,1]=4 50 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [1,0,0,0,0,0|2,0,0]=3 51 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [1,0,0,0,0,0|3,0,0]=4 52 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [1,0,0,0,0,0|3,0,0]=4 53 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [1,0,0,0,0,0|2,0,1]=4 54 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [1,0,0,0,0,0|3,0,0]=4 55 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [1,0,0,0,0,0|3,0,0]=4 56 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [1,0,0,0,0,0|2,0,0]=3 57 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [1,0,0,0,0,0|2,0,1]=4 58 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [1,0,0,0,0,0|2,0,1]=4 59 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [1,0,0,0,0,0|3,0,0]=4 60 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [1,0,0,0,0,0|1,0,2]=4 61 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [1,0,0,0,0,0|1,0,0]=2 62 B13R2.328 O=c1cc(c2cccnc2[nH]1)O 271570a_203496583355_100010499609 [1,0,0,0,0,0|2,0,0]=3 63 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [1,0,0,0,0,0|1,0,1]=3 64 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [1,0,0,0,0,0|1,0,1]=3 65 B13R2.328 Oc1cc(c2cnccc2c1)O 271570a_203496583355_100011009069 [1,0,0,0,0,0|2,0,1]=4 66 B13R2.328 Oc1cc(c2ncccc2c1)O 271570a_203496583355_100010248853 [1,0,0,0,0,0|2,0,1]=4 67 B13R2.328 Oc1cc(cc2c1nccc2)Br 271570a_203496583355_100010090713 [1,0,0,0,0,0|3,0,0]=4 68 B13R2.328 Oc1cc(cc2c1nccc2)F 271570a_203496583355_100010214460 [1,0,0,0,0,0|3,0,0]=4 69 B13R2.328 [O-][n+]1cc(c2ccccc2c1)O 271570a_203496583355_100009995557 [1,0,0,0,0,0|2,0,1]=4 70 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [1,0,0,0,0,0|3,0,0]=4 71 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [1,0,0,0,0,0|3,0,0]=4 72 B13R2.5179 Cc1ccc2c(ncnc2c1)O 271570a_203496583355_100000099684 [1,0,0,0,0,0|3,0,0]=4 73 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [1,0,0,0,0,0|3,0,0]=4 74 B13R2.5179 Cc1ccnc2c1ccc(c2)O 271570a_203496583355_100010132309 [1,0,0,0,0,0|2,0,0]=3 75 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [1,0,0,0,0,0|3,0,0]=4 76 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [1,0,0,0,0,0|3,0,0]=4 77 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [1,0,0,0,0,0|2,0,0]=3 78 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [1,0,0,0,0,0|3,0,0]=4 79 B13R2.5179 Nc1ccnc2c1ccc(c2)O 271570a_203496583355_200009816820 [1,0,0,0,0,0|2,0,0]=3 80 B13R2.5179 Nc1nccc2c1ccc(c2)O 271570a_203496583355_100000732483 [1,0,0,0,0,0|3,0,0]=4 81 B13R2.5179 Nc1ncnc2c1ccc(c2)O 271570a_203496583355_100010199758 [1,0,0,0,0,0|3,0,0]=4 82 B13R2.5179 O=C1CCOc2c1ccc(c2)O 271570a_203496583355_100000696939 [1,0,0,0,0,0|0,0,3]=4 83 B13R2.5179 O=c1[nH]cnc2c1ccc(c2)O 271570a_203496583355_100000230960 [1,0,0,0,0,0|2,0,1]=4 84 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [1,0,0,0,0,0|2,0,1]=4 85 B13R2.5179 O=c1ccoc2c1ccc(c2)O 271570a_203496583355_100010062221 [1,0,0,0,0,0|0,0,1]=2 86 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [1,0,0,0,0,0|2,0,0]=3 87 B13R2.5179 Oc1cc2ccnc(c2cn1)O 271570a_203496583355_100020669822 [1,0,0,0,0,0|3,0,0]=4 88 B13R2.5179 Oc1ccc2c(c1)OCCC2O 271570a_203496583355_100012676011 [1,0,0,0,0,0|0,0,3]=4 89 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [1,0,0,0,0,0|1,0,0]=2 90 B13R2.5179 Oc1ccc2c(ccnc2c1)Cl 271570a_203496583355_100009996786 [1,0,0,0,0,0|2,0,0]=3 91 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045489 [1,0,0,0,0,0|1,0,0]=2 92 B13R2.5179 Oc1ccc2c(ccnc2c1)O 271570a_203496583355_100000756855 [1,0,0,0,0,0|1,0,0]=2 93 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100000760485 [1,0,0,0,0,0|2,0,0]=3 94 B13R2.5179 Oc1ccc2c(nccc2c1)O 271570a_203496583355_100009867704 [1,0,0,0,0,0|2,0,0]=3 95 B13R2.5179 Oc1ccc2c(ncnc2n1)O 271570a_203496583355_100000092995 [1,0,0,0,0,0|3,0,0]=4 96 B13R2.5179 Oc1ccc2c(nncc2c1)O 271570a_203496583355_100000724280 [1,0,0,0,0,0|3,0,0]=4 97 B13R2.5179 Oc1ccnc2c1ccc(c2)Cl 271570a_203496583355_100012352046 [1,0,0,0,0,0|2,0,0]=3 98 B13R2.5179 Oc1ccnc2c1ccc(c2)F 271570a_203496583355_100000755548 [1,0,0,0,0,0|2,0,0]=3 99 B13R2.5179 Oc1ccnc2c1ncc(c2)F 271570a_203496583355_100011072215 [1,0,0,0,0,0|3,0,0]=4 100 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [1,0,0,0,0,0|3,0,0]=4 101 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [1,0,0,0,0,0|3,0,0]=4 102 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [1,0,0,0,0,0|3,0,0]=4 103 B13R2.5179 Oc1cnc2c(nccc2c1)O 271570a_203496583355_100010117065 [1,0,0,0,0,0|3,0,0]=4 104 B13R2.5179 Oc1nccc2c1ccc(c2)F 271570a_203496583355_100000097391 [1,0,0,0,0,0|3,0,0]=4 105 B13R2.5179 Oc1ncnc2c1ccc(c2)F 271570a_203496583355_100000230349 [1,0,0,0,0,0|3,0,0]=4 106 B13R2.5179 [O-][n+]1ccc2c(cccc2c1)O 271570a_203496583355_200010126733 [1,0,0,0,0,0|2,0,1]=4 107 B15R2.22666 COc1cc(=O)oc2c1ccc(c2)Br 7a_100010062223_200000210301 [0,1,0,0,0,0|1,0,0]=2 108 B15R2.22666 COc1cc(=O)oc2c1ccc(c2)F 7a_100009876825_200000210301 [0,1,0,0,0,0|1,0,0]=2 109 B15R2.22666 [13CH3]Oc1cc(=O)oc2c1ccc(c2)Br 7a_100010062223_200025704644 [0,1,0,0,0,0|1,0,0]=2 110 B15R2.22666 [13CH3]Oc1cc(=O)oc2c1ccc(c2)F 7a_100009876825_200025704644 [0,1,0,0,0,0|1,0,0]=2 111 B15R2.63893 Cc1c(c(=O)oc2c1ccc(c2)O)O 271570a_203496583355_200009996780 [0,1,0,0,0,0|1,0,0]=2 112 B15R2.63893 Cn1c(=O)c(=O)[nH]c2c1ccc(c2)O 271570a_203496583355_100009998729 [0,1,0,0,0,0|3,0,0]=4 113 B15R2.63910 Cc1cc(=O)c2ccc(c(c2[nH]1)C)O 271570a_203496583355_100012349997 [0,1,0,0,0,0|2,0,1]=4 114 B15R2.89396 C=Cc1ccc2c(cc(=O)oc2c1)O 271570a_100011290941_100010062223 [0,1,0,0,0,0|1,0,0]=2 115 B15R2.89396 CC1CC(=O)Oc2c1ccc(c2)O[13CH3] 7a_100010659126_200025704644 [0,1,0,0,0,0|1,0,2]=4 116 B15R2.89396 CNc1ccc2c(cc(=O)oc2c1)C 7a_100000010859_200000210301 [0,1,0,0,0,0|2,0,0]=3 117 B15R2.89396 COc1ccc2c([nH]c(=O)cc2c1)O 271570a_203496583355_100010989755 [0,1,0,0,0,0|2,0,0]=3 118 B15R2.89396 COc1ccc2c(c1)OC(=O)CC2C 7a_100010659126_200000210301 [0,1,0,0,0,0|1,0,2]=4 119 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 34a_100000181958_200000210301 [0,1,0,0,0,0|1,0,0]=2 120 B15R2.89396 COc1ccc2c(cc(=O)oc2c1)C 7a_100000181958_200000210301 [0,1,0,0,0,0|1,0,0]=2 121 B15R2.89396 COc1ccc2c(cc(nc2c1)C)O 271570a_203496583355_100000044451 [0,1,0,0,0,0|2,0,0]=3 122 B15R2.89396 COc1ccc2c(cc(nc2c1)O)C 271570a_203496583355_100000010170 [0,1,0,0,0,0|2,0,1]=4 123 B15R2.89396 CSc1ccc2c(cc(=O)oc2c1)O 62a_200000210301_100010062223 [0,1,0,0,0,0|0,1,0]=2 124 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)N[13CH3] 7a_100000010859_200025704644 [0,1,0,0,0,0|2,0,0]=3 125 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 34a_100000181958_200025704644 [0,1,0,0,0,0|1,0,0]=2 126 B15R2.89396 Cc1cc(=O)oc2c1ccc(c2)O[13CH3] 7a_100000181958_200025704644 [0,1,0,0,0,0|1,0,0]=2 127 B15R2.89396 [13CH3]Sc1ccc2c(cc(=O)oc2c1)O 62a_200025704644_100010062223 [0,1,0,0,0,0|0,1,0]=2 128 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000210193_100011660834 [0,0,1,0,0,0|2,0,1]=4 129 B13R1.20 C=CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000210623 [0,0,1,0,0,0|2,0,1]=4 130 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210193 [0,0,1,0,0,0|2,0,1]=4 131 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 22a_100000210217_100000210193 [0,0,1,0,0,0|2,0,1]=4 132 B13R1.20 C=CCC(=O)Nc1cccc(c1)O 527a_100000210217_100000210193 [0,0,1,0,0,0|2,0,1]=4 133 B13R1.20 CC=CC(=O)Cc1cccc(c1)Br 1458a_100000210699_100000211773 [0,0,1,0,0,0|3,0,0]=4 134 B13R1.20 CC=CC(=O)Cc1cccc(c1)C 1458a_100000210699_100000211840 [0,0,1,0,0,0|3,0,0]=4 135 B13R1.20 CC=CC(=O)Cc1cccc(c1)Cl 1458a_100000210699_100000181238 [0,0,1,0,0,0|3,0,0]=4 136 B13R1.20 CC=CC(=O)Cc1cccc(c1)F 1458a_100000210699_100000230114 [0,0,1,0,0,0|3,0,0]=4 137 B13R1.20 CC=CC(=O)Cc1cccc(c1)I 1458a_100000210699_100011218688 [0,0,1,0,0,0|3,0,0]=4 138 B13R1.20 CC=CC(=O)Cc1cccc(c1)O 1458a_100000210699_100011660834 [0,0,1,0,0,0|2,0,0]=3 139 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 11a_100000210019_100000210699 [0,0,1,0,0,0|3,0,0]=4 140 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000210699 [0,0,1,0,0,0|3,0,0]=4 141 B13R1.20 CC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000210699 [0,0,1,0,0,0|3,0,0]=4 142 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 11a_100000188690_100000210699 [0,0,1,0,0,0|3,0,0]=4 143 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000210699 [0,0,1,0,0,0|3,0,0]=4 144 B13R1.20 CC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000210699 [0,0,1,0,0,0|3,0,0]=4 145 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100000210699 [0,0,1,0,0,0|3,0,0]=4 146 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000210699 [0,0,1,0,0,0|3,0,0]=4 147 B13R1.20 CC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000210699 [0,0,1,0,0,0|3,0,0]=4 148 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 11a_100000210047_100000210699 [0,0,1,0,0,0|3,0,0]=4 149 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000210699 [0,0,1,0,0,0|3,0,0]=4 150 B13R1.20 CC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000210699 [0,0,1,0,0,0|3,0,0]=4 151 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 11a_100000211102_100000210699 [0,0,1,0,0,0|3,0,0]=4 152 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000210699 [0,0,1,0,0,0|3,0,0]=4 153 B13R1.20 CC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000210699 [0,0,1,0,0,0|3,0,0]=4 154 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000210699 [0,0,1,0,0,0|2,0,0]=3 155 B13R1.20 CC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000210699 [0,0,1,0,0,0|2,0,0]=3 156 B13R1.20 Cc1cccc(c1)CC(=O)C=CBr 1458a_100016273825_100000211840 [0,0,1,0,0,0|3,0,0]=4 157 B13R1.20 Cc1cccc(c1)CC(=O)C=CCl 1458a_200016279998_100000211840 [0,0,1,0,0,0|3,0,0]=4 158 B13R1.20 Cc1cccc(c1)CC(=O)C=CI 1458a_100016256311_100000211840 [0,0,1,0,0,0|3,0,0]=4 159 B13R1.20 Cc1cccc(c1)NC(=O)C=CBr 1626a_100000188690_100016273825 [0,0,1,0,0,0|3,0,0]=4 160 B13R1.20 Cc1cccc(c1)NC(=O)C=CCl 11a_100000188690_200016279998 [0,0,1,0,0,0|3,0,0]=4 161 B13R1.20 Cc1cccc(c1)NC(=O)C=CCl 1626a_100000188690_200016279998 [0,0,1,0,0,0|3,0,0]=4 162 B13R1.20 Cc1cccc(c1)NC(=O)C=CI 1626a_100000188690_100016256311 [0,0,1,0,0,0|3,0,0]=4 163 B13R1.20 O=C(C=CBr)Cc1cccc(c1)Br 1458a_100016273825_100000211773 [0,0,1,0,0,0|3,0,0]=4 164 B13R1.20 O=C(C=CBr)Cc1cccc(c1)Cl 1458a_100016273825_100000181238 [0,0,1,0,0,0|3,0,0]=4 165 B13R1.20 O=C(C=CBr)Cc1cccc(c1)F 1458a_100016273825_100000230114 [0,0,1,0,0,0|3,0,0]=4 166 B13R1.20 O=C(C=CBr)Cc1cccc(c1)I 1458a_100016273825_100011218688 [0,0,1,0,0,0|3,0,0]=4 167 B13R1.20 O=C(C=CBr)Cc1cccc(c1)O 1458a_100016273825_100011660834 [0,0,1,0,0,0|2,0,0]=3 168 B13R1.20 O=C(C=CBr)Nc1cccc(c1)Br 1626a_100000210019_100016273825 [0,0,1,0,0,0|3,0,0]=4 169 B13R1.20 O=C(C=CBr)Nc1cccc(c1)Cl 1626a_100000185859_100016273825 [0,0,1,0,0,0|3,0,0]=4 170 B13R1.20 O=C(C=CBr)Nc1cccc(c1)F 1626a_100000210047_100016273825 [0,0,1,0,0,0|3,0,0]=4 171 B13R1.20 O=C(C=CBr)Nc1cccc(c1)I 1626a_100000211102_100016273825 [0,0,1,0,0,0|3,0,0]=4 172 B13R1.20 O=C(C=CBr)Nc1cccc(c1)O 1626a_100000210217_100016273825 [0,0,1,0,0,0|2,0,0]=3 173 B13R1.20 O=C(C=CCl)Cc1cccc(c1)Br 1458a_200016279998_100000211773 [0,0,1,0,0,0|3,0,0]=4 174 B13R1.20 O=C(C=CCl)Cc1cccc(c1)Cl 1458a_200016279998_100000181238 [0,0,1,0,0,0|3,0,0]=4 175 B13R1.20 O=C(C=CCl)Cc1cccc(c1)F 1458a_200016279998_100000230114 [0,0,1,0,0,0|3,0,0]=4 176 B13R1.20 O=C(C=CCl)Cc1cccc(c1)I 1458a_200016279998_100011218688 [0,0,1,0,0,0|3,0,0]=4 177 B13R1.20 O=C(C=CCl)Cc1cccc(c1)O 1458a_200016279998_100011660834 [0,0,1,0,0,0|2,0,0]=3 178 B13R1.20 O=C(C=CCl)Nc1cccc(c1)Br 11a_100000210019_200016279998 [0,0,1,0,0,0|3,0,0]=4 179 B13R1.20 O=C(C=CCl)Nc1cccc(c1)Br 1626a_100000210019_200016279998 [0,0,1,0,0,0|3,0,0]=4 180 B13R1.20 O=C(C=CCl)Nc1cccc(c1)Cl 11a_100000185859_200016279998 [0,0,1,0,0,0|3,0,0]=4 181 B13R1.20 O=C(C=CCl)Nc1cccc(c1)Cl 1626a_100000185859_200016279998 [0,0,1,0,0,0|3,0,0]=4 182 B13R1.20 O=C(C=CCl)Nc1cccc(c1)F 11a_100000210047_200016279998 [0,0,1,0,0,0|3,0,0]=4 183 B13R1.20 O=C(C=CCl)Nc1cccc(c1)F 1626a_100000210047_200016279998 [0,0,1,0,0,0|3,0,0]=4 184 B13R1.20 O=C(C=CCl)Nc1cccc(c1)I 11a_100000211102_200016279998 [0,0,1,0,0,0|3,0,0]=4 185 B13R1.20 O=C(C=CCl)Nc1cccc(c1)I 1626a_100000211102_200016279998 [0,0,1,0,0,0|3,0,0]=4 186 B13R1.20 O=C(C=CCl)Nc1cccc(c1)O 1626a_100000210217_200016279998 [0,0,1,0,0,0|2,0,0]=3 187 B13R1.20 O=C(C=CI)Cc1cccc(c1)Br 1458a_100016256311_100000211773 [0,0,1,0,0,0|3,0,0]=4 188 B13R1.20 O=C(C=CI)Cc1cccc(c1)Cl 1458a_100016256311_100000181238 [0,0,1,0,0,0|3,0,0]=4 189 B13R1.20 O=C(C=CI)Cc1cccc(c1)F 1458a_100016256311_100000230114 [0,0,1,0,0,0|3,0,0]=4 190 B13R1.20 O=C(C=CI)Cc1cccc(c1)I 1458a_100016256311_100011218688 [0,0,1,0,0,0|3,0,0]=4 191 B13R1.20 O=C(C=CI)Cc1cccc(c1)O 1458a_100016256311_100011660834 [0,0,1,0,0,0|2,0,0]=3 192 B13R1.20 O=C(C=CI)Nc1cccc(c1)Br 1626a_100000210019_100016256311 [0,0,1,0,0,0|3,0,0]=4 193 B13R1.20 O=C(C=CI)Nc1cccc(c1)Cl 1626a_100000185859_100016256311 [0,0,1,0,0,0|3,0,0]=4 194 B13R1.20 O=C(C=CI)Nc1cccc(c1)F 1626a_100000210047_100016256311 [0,0,1,0,0,0|3,0,0]=4 195 B13R1.20 O=C(C=CI)Nc1cccc(c1)I 1626a_100000211102_100016256311 [0,0,1,0,0,0|3,0,0]=4 196 B13R1.20 O=C(C=CI)Nc1cccc(c1)O 1626a_100000210217_100016256311 [0,0,1,0,0,0|2,0,0]=3 197 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100000745134_100000211926 [0,0,1,0,0,0|1,0,2]=4 198 B13R1.20 O=C(CCO)Cc1cccc(c1)O 1458a_100011216618_100011660834 [0,0,1,0,0,0|1,0,2]=4 199 B13R1.20 O=C(CCO)Nc1cccc(c1)O 22a_100000210217_100011216618 [0,0,1,0,0,0|1,0,2]=4 200 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 1458a_100000070787_100009814261 [0,0,1,0,0,0|1,0,2]=4 201 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100000184285 [0,0,1,0,0,0|1,0,2]=4 202 B13R1.132 NC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000187820 [0,0,1,0,0,0|1,0,2]=4 203 B13R1.132 O=C([O-])CC(=O)c1ccc(cc1)O 1458a_100000212099_100020667443 [0,0,1,0,0,0|0,0,3]=4 204 B13R1.1511 C=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000210623 [0,0,1,0,0,0|1,0,2]=4 205 B13R1.3089 C=Cc1ccc(cc1OC(=O)C)F 271570a_100011290941_200015685721 [0,0,1,0,0,0|2,0,1]=4 206 B13R1.3089 COc1ccc(cc1OC(=O)C)O 271570a_203496583355_200011016479 [0,0,1,0,0,0|2,0,1]=4 207 B13R2.5187 O=C1CC(=O)c2c1ccc(c2)O 271570a_203496583355_100009997049 [0,0,0,0,1,0|0,0,2]=3 208 B13R2.5187 O=C1NC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185758 [0,0,0,0,1,0|1,0,1]=3 209 B13R2.5187 O=C1OC(=O)c2c1cc(cn2)O 271570a_203496583355_100010218301 [0,0,0,0,1,0|2,0,1]=4 210 B13R2.5187 O=C1OC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185860 [0,0,0,0,1,0|1,0,1]=3 211 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,0,0,0,1,0|2,0,1]=4 212 B13R2.5190 CN1C(=O)Cc2c1ccc(c2)O 271570a_203496583355_100000183948 [0,0,0,0,1,0|3,0,0]=4 213 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,0,0,0,1,0|2,0,0]=3 214 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,0,0,0,1,0|1,0,1]=3 215 B12R1.32 CC=CC(=O)Cc1ccccc1 1458a_100000210699_100015291786 [1,0,1,0,0,0|2,0,0]=4 216 B12R1.32 CC=CC(=O)Nc1ccccc1 11a_100000106764_100000210699 [1,0,1,0,0,0|2,0,0]=4 217 B12R1.32 CC=CC(=O)Nc1ccccc1 1626a_100000106764_100000210699 [1,0,1,0,0,0|2,0,0]=4 218 B12R1.32 CC=CC(=O)Nc1ccccc1 22a_100000106764_100000210699 [1,0,1,0,0,0|2,0,0]=4 219 B12R1.32 O=C(C=CBr)Cc1ccccc1 1458a_100016273825_100015291786 [1,0,1,0,0,0|2,0,0]=4 220 B12R1.32 O=C(C=CBr)Nc1ccccc1 1626a_100000106764_100016273825 [1,0,1,0,0,0|2,0,0]=4 221 B12R1.32 O=C(C=CCl)Cc1ccccc1 1458a_200016279998_100015291786 [1,0,1,0,0,0|2,0,0]=4 222 B12R1.32 O=C(C=CCl)Nc1ccccc1 11a_100000106764_200016279998 [1,0,1,0,0,0|2,0,0]=4 223 B12R1.32 O=C(C=CCl)Nc1ccccc1 1626a_100000106764_200016279998 [1,0,1,0,0,0|2,0,0]=4 224 B12R1.32 O=C(C=CI)Cc1ccccc1 1458a_100016256311_100015291786 [1,0,1,0,0,0|2,0,0]=4 225 B12R1.32 O=C(C=CI)Nc1ccccc1 1626a_100000106764_100016256311 [1,0,1,0,0,0|2,0,0]=4 226 B12R1.50 C=CC(=O)Cc1cccc(c1)Br 1458a_100000185746_100000211773 [1,0,1,0,0,0|2,0,0]=4 227 B12R1.50 C=CC(=O)Cc1cccc(c1)C 1458a_100000185746_100000211840 [1,0,1,0,0,0|2,0,0]=4 228 B12R1.50 C=CC(=O)Cc1cccc(c1)Cl 1458a_100000185746_100000181238 [1,0,1,0,0,0|2,0,0]=4 229 B12R1.50 C=CC(=O)Cc1cccc(c1)F 1458a_100000185746_100000230114 [1,0,1,0,0,0|2,0,0]=4 230 B12R1.50 C=CC(=O)Cc1cccc(c1)I 1458a_100000185746_100011218688 [1,0,1,0,0,0|2,0,0]=4 231 B12R1.50 C=CC(=O)Cc1cccc(c1)O 1458a_100000185746_100011660834 [1,0,1,0,0,0|1,0,0]=3 232 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100000185746 [1,0,1,0,0,0|2,0,0]=4 233 B12R1.50 C=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000185746 [1,0,1,0,0,0|2,0,0]=4 234 B12R1.50 C=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100000185746 [1,0,1,0,0,0|2,0,0]=4 235 B12R1.50 C=CC(=O)Nc1cccc(c1)C 22a_100000188690_100000185746 [1,0,1,0,0,0|2,0,0]=4 236 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100000185746 [1,0,1,0,0,0|2,0,0]=4 237 B12R1.50 C=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000185746 [1,0,1,0,0,0|2,0,0]=4 238 B12R1.50 C=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100000185746 [1,0,1,0,0,0|2,0,0]=4 239 B12R1.50 C=CC(=O)Nc1cccc(c1)F 22a_100000210047_100000185746 [1,0,1,0,0,0|2,0,0]=4 240 B12R1.50 C=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100000185746 [1,0,1,0,0,0|2,0,0]=4 241 B12R1.50 C=CC(=O)Nc1cccc(c1)I 22a_100000211102_100000185746 [1,0,1,0,0,0|2,0,0]=4 242 B12R1.50 C=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000185746 [1,0,1,0,0,0|1,0,0]=3 243 B12R1.50 C=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000185746 [1,0,1,0,0,0|1,0,0]=3 244 B12R1.50 O=C(CO)Cc1cccc(c1)O 1458a_100000210174_100011660834 [1,0,1,0,0,0|1,0,1]=4 245 B12R1.50 O=C(CO)Nc1cccc(c1)O 22a_100000210217_100000210174 [1,0,1,0,0,0|1,0,1]=4 246 B12R1.50 O=C(CO)Nc1cccc(c1)O 527a_100000210217_100000210174 [1,0,1,0,0,0|1,0,1]=4 247 B12R1.21 CC(=O)/C=C/c1ccc(cc1)O 271570a_203496583355_200016259395 [1,0,1,0,0,0|1,0,0]=3 248 B12R1.21 CC(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200000210301 [1,0,1,0,0,0|2,0,0]=4 249 B12R1.21 CC(=O)C=Cc1ccc(cc1)C 1458a_100000716854_200000210301 [1,0,1,0,0,0|2,0,0]=4 250 B12R1.21 CC(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200000210301 [1,0,1,0,0,0|2,0,0]=4 251 B12R1.21 CC(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200000210301 [1,0,1,0,0,0|2,0,0]=4 252 B12R1.21 CC(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200000210301 [1,0,1,0,0,0|2,0,0]=4 253 B12R1.21 CC(O)C=Cc1ccc(cc1)O 271570a_200011019289_100000185759 [1,0,1,0,0,0|1,0,1]=4 254 B12R1.21 Cc1ccc(cc1)C=CC(=O)[13CH3] 1458a_100000716854_200025704644 [1,0,1,0,0,0|2,0,0]=4 255 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Br 1458a_100016267368_200025704644 [1,0,1,0,0,0|2,0,0]=4 256 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)Cl 1458a_100000184863_200025704644 [1,0,1,0,0,0|2,0,0]=4 257 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)F 1458a_100000182136_200025704644 [1,0,1,0,0,0|2,0,0]=4 258 B12R1.21 [13CH3]C(=O)C=Cc1ccc(cc1)I 1458a_100102526154_200025704644 [1,0,1,0,0,0|2,0,0]=4 259 B12R1.107 CC(=CC(=O)[13CH3])c1ccccc1 1458a_100000743005_200025704644 [1,0,1,0,0,0|2,0,0]=4 260 B12R1.107 CC(=O)C=C(C)c1ccccc1 1458a_100000743005_200000210301 [1,0,1,0,0,0|2,0,0]=4 261 B12R1.69 O=CCNc1ccc(cc1O)O 34a_100000106777_200009817547 [1,0,1,0,0,0|1,0,1]=4 262 B12R1.69 O=CCSc1ccc(cc1O)O 62a_200015260668_100009813921 [1,0,1,0,0,0|1,0,1]=4 263 B12R1.57 C=C(C)c1ccc(cc1C=O)Br 271570a_100000694244_100010185651 [1,0,1,0,0,0|2,0,0]=4 264 B12R1.57 C=C(C)c1ccc(cc1C=O)C 271570a_100000694244_100011551863 [1,0,1,0,0,0|2,0,0]=4 265 B12R1.57 C=C(C)c1ccc(cc1C=O)Cl 271570a_100000694244_100010254386 [1,0,1,0,0,0|2,0,0]=4 266 B12R1.57 C=C(C)c1ccc(cc1C=O)F 271570a_100000694244_100011218309 [1,0,1,0,0,0|2,0,0]=4 267 B12R1.57 C=C(C)c1ccc(cc1C=O)O 271570a_100000694244_100000690577 [1,0,1,0,0,0|1,0,0]=3 268 B12R1.57 C=C(C)c1ccc(cc1OC)O 271570a_100000694244_100011827694 [1,0,1,0,0,0|1,0,1]=4 269 B12R1.127 CC(=O)Cc1cc(ccc1O)O 1458a_100000038496_200000210301 [1,0,1,0,0,0|1,0,1]=4 270 B12R1.127 CC(=O)Cc1cc(ccc1O)O 271570a_203496583355_200010006938 [1,0,1,0,0,0|1,0,1]=4 271 B12R1.127 CC(=O)Oc1cc(ccc1C)O 271570a_203496583355_100103282185 [1,0,1,0,0,0|0,0,2]=4 272 B12R1.127 CC(=O)Oc1cc(ccc1O)F 271570a_203496583355_200015685721 [1,0,1,0,0,0|1,0,1]=4 273 B12R1.127 [13CH3]C(=O)Cc1cc(ccc1O)O 1458a_100000038496_200025704644 [1,0,1,0,0,0|1,0,1]=4 274 B12R1.75 C=Cc1ccccc1OC(=O)C 271570a_100011290941_100000051690 [1,0,1,0,0,0|1,0,1]=4 275 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [2,0,0,0,0,0|2,0,0]=4 276 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [2,0,0,0,0,0|1,0,0]=3 277 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [2,0,0,0,0,0|1,0,1]=4 278 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [2,0,0,0,0,0|1,0,0]=3 279 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [2,0,0,0,0,0|2,0,0]=4 280 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [2,0,0,0,0,0|2,0,0]=4 281 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [2,0,0,0,0,0|2,0,0]=4 282 B12R2.24 Oc1ccc2cncnc2c1 271570a_203496583355_100010185614 [2,0,0,0,0,0|2,0,0]=4 283 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [2,0,0,0,0,0|2,0,0]=4 284 B12R2.24 Oc1ccc2nccnc2c1 271570a_203496583355_100011219451 [2,0,0,0,0,0|2,0,0]=4 285 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [2,0,0,0,0,0|2,0,0]=4 286 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [2,0,0,0,0,0|2,0,0]=4 287 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [2,0,0,0,0,0|1,0,0]=3 288 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [2,0,0,0,0,0|2,0,0]=4 289 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [2,0,0,0,0,0|2,0,0]=4 290 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [2,0,0,0,0,0|2,0,0]=4 291 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [2,0,0,0,0,0|2,0,0]=4 292 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [2,0,0,0,0,0|1,0,0]=3 293 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [2,0,0,0,0,0|2,0,0]=4 294 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [2,0,0,0,0,0|2,0,0]=4 295 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [2,0,0,0,0,0|2,0,0]=4 296 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [2,0,0,0,0,0|2,0,0]=4 297 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [2,0,0,0,0,0|2,0,0]=4 298 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [2,0,0,0,0,0|2,0,0]=4 299 B14R1.17 CC=CC(=O)Nc1cccc(c1Br)O 22a_100012183704_100000210699 [0,1,1,0,0,0|2,0,0]=4 300 B14R1.17 CC=CC(=O)Nc1cccc(c1C)O 11a_100011216573_100000210699 [0,1,1,0,0,0|2,0,0]=4 301 B14R1.17 CC=CC(=O)Nc1cccc(c1C)O 22a_100011216573_100000210699 [0,1,1,0,0,0|2,0,0]=4 302 B14R1.17 CC=CC(=O)Nc1cccc(c1Cl)O 22a_100012002038_100000210699 [0,1,1,0,0,0|2,0,0]=4 303 B14R1.17 Cc1c(cccc1NC(=O)C=CCl)O 11a_100011216573_200016279998 [0,1,1,0,0,0|2,0,0]=4 304 B14R1.34 C/C=C/CC(=O)Cc1cccc(c1)O 1458a_100000745134_100102629194 [0,1,1,0,0,0|2,0,0]=4 305 B14R1.34 C=CC=CC(=O)Cc1cccc(c1)O 1458a_100016291481_100011660834 [0,1,1,0,0,0|2,0,0]=4 306 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100016291481 [0,1,1,0,0,0|2,0,0]=4 307 B14R1.34 C=CC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100016291481 [0,1,1,0,0,0|2,0,0]=4 308 B14R1.34 CC=CCC(=O)Cc1cccc(c1)O 1458a_100000745134_100000070051 [0,1,1,0,0,0|2,0,0]=4 309 B14R1.34 CC=CCC(=O)Cc1cccc(c1)O 1458a_100121576822_100011660834 [0,1,1,0,0,0|2,0,0]=4 310 B14R1.34 CC=CCC(=O)Nc1cccc(c1)O 1626a_100000210217_100121576822 [0,1,1,0,0,0|2,0,0]=4 311 B14R1.34 CC=CCC(=O)Nc1cccc(c1)O 22a_100000210217_100121576822 [0,1,1,0,0,0|2,0,0]=4 312 B14R1.34 CC=CCC(=O)Nc1cccc(c1)O 527a_100000210217_100121576822 [0,1,1,0,0,0|2,0,0]=4 313 B14R1.34 CCC=CC(=O)Cc1cccc(c1)O 1458a_100000212282_100011660834 [0,1,1,0,0,0|2,0,0]=4 314 B14R1.34 CCC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100000212282 [0,1,1,0,0,0|2,0,0]=4 315 B14R1.34 CCC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100000212282 [0,1,1,0,0,0|2,0,0]=4 316 B14R1.34 COC=CC(=O)Cc1cccc(c1)Br 1458a_100016268678_100000211773 [0,1,1,0,0,0|2,0,0]=4 317 B14R1.34 COC=CC(=O)Cc1cccc(c1)C 1458a_100016268678_100000211840 [0,1,1,0,0,0|2,0,0]=4 318 B14R1.34 COC=CC(=O)Cc1cccc(c1)Cl 1458a_100016268678_100000181238 [0,1,1,0,0,0|2,0,0]=4 319 B14R1.34 COC=CC(=O)Cc1cccc(c1)F 1458a_100016268678_100000230114 [0,1,1,0,0,0|2,0,0]=4 320 B14R1.34 COC=CC(=O)Cc1cccc(c1)I 1458a_100016268678_100011218688 [0,1,1,0,0,0|2,0,0]=4 321 B14R1.34 COC=CC(=O)Cc1cccc(c1)O 1458a_100016268678_100011660834 [0,1,1,0,0,0|1,0,0]=3 322 B14R1.34 COC=CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100016268678 [0,1,1,0,0,0|2,0,0]=4 323 B14R1.34 COC=CC(=O)Nc1cccc(c1)Br 22a_100000210019_100016268678 [0,1,1,0,0,0|2,0,0]=4 324 B14R1.34 COC=CC(=O)Nc1cccc(c1)C 1626a_100000188690_100016268678 [0,1,1,0,0,0|2,0,0]=4 325 B14R1.34 COC=CC(=O)Nc1cccc(c1)C 22a_100000188690_100016268678 [0,1,1,0,0,0|2,0,0]=4 326 B14R1.34 COC=CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100016268678 [0,1,1,0,0,0|2,0,0]=4 327 B14R1.34 COC=CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100016268678 [0,1,1,0,0,0|2,0,0]=4 328 B14R1.34 COC=CC(=O)Nc1cccc(c1)F 1626a_100000210047_100016268678 [0,1,1,0,0,0|2,0,0]=4 329 B14R1.34 COC=CC(=O)Nc1cccc(c1)F 22a_100000210047_100016268678 [0,1,1,0,0,0|2,0,0]=4 330 B14R1.34 COC=CC(=O)Nc1cccc(c1)I 1626a_100000211102_100016268678 [0,1,1,0,0,0|2,0,0]=4 331 B14R1.34 COC=CC(=O)Nc1cccc(c1)I 22a_100000211102_100016268678 [0,1,1,0,0,0|2,0,0]=4 332 B14R1.34 COC=CC(=O)Nc1cccc(c1)O 1626a_100000210217_100016268678 [0,1,1,0,0,0|1,0,0]=3 333 B14R1.34 COC=CC(=O)Nc1cccc(c1)O 22a_100000210217_100016268678 [0,1,1,0,0,0|1,0,0]=3 334 B14R1.135 C/C=C(\C)/C(=O)Cc1cccc(c1)O 1458a_100020587367_100011660834 [0,1,1,0,0,0|2,0,0]=4 335 B14R1.135 C/C=C(\C)/C(=O)Nc1cccc(c1)O 1626a_100000210217_100020587367 [0,1,1,0,0,0|2,0,0]=4 336 B14R1.135 C/C=C(\C)/C(=O)Nc1cccc(c1)O 22a_100000210217_100020587367 [0,1,1,0,0,0|2,0,0]=4 337 B14R1.135 C=C(CO)C(=O)Nc1cccc(c1)O 22a_100000210217_200000705526 [0,1,1,0,0,0|1,0,1]=4 338 B14R1.950 CC=CC(=O)Nc1cc(ccc1Br)O 22a_100011999798_100000210699 [0,1,1,0,0,0|2,0,0]=4 339 B14R1.950 CC=CC(=O)Nc1cc(ccc1C)O 22a_100011216113_100000210699 [0,1,1,0,0,0|2,0,0]=4 340 B14R1.950 CC=CC(=O)Nc1cc(ccc1F)O 1626a_100012017239_100000210699 [0,1,1,0,0,0|2,0,0]=4 341 B14R1.950 CC=CC(=O)Nc1cc(ccc1F)O 22a_100012017239_100000210699 [0,1,1,0,0,0|2,0,0]=4 342 B14R1.950 O=C(C=CBr)Nc1cc(ccc1F)O 1626a_100012017239_100016273825 [0,1,1,0,0,0|2,0,0]=4 343 B14R1.950 O=C(C=CCl)Nc1cc(ccc1F)O 1626a_100012017239_200016279998 [0,1,1,0,0,0|2,0,0]=4 344 B14R1.950 O=C(C=CI)Nc1cc(ccc1F)O 1626a_100012017239_100016256311 [0,1,1,0,0,0|2,0,0]=4 345 B14R1.952 CC=CC(=O)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100000210699 [0,1,1,0,0,0|2,0,0]=4 346 B14R1.952 CC=CC(=O)Nc1cc(cc(c1)Cl)O 22a_100000123917_100000210699 [0,1,1,0,0,0|2,0,0]=4 347 B14R1.952 CC=CC(=O)Nc1cc(cc(c1)O)C 1626a_100011995906_100000210699 [0,1,1,0,0,0|2,0,0]=4 348 B14R1.952 CC=CC(=O)Nc1cc(cc(c1)O)C 22a_100011995906_100000210699 [0,1,1,0,0,0|2,0,0]=4 349 B14R1.952 Cc1cc(cc(c1)NC(=O)C=CBr)O 1626a_100011995906_100016273825 [0,1,1,0,0,0|2,0,0]=4 350 B14R1.952 Cc1cc(cc(c1)NC(=O)C=CCl)O 1626a_100011995906_200016279998 [0,1,1,0,0,0|2,0,0]=4 351 B14R1.952 Cc1cc(cc(c1)NC(=O)C=CI)O 1626a_100011995906_100016256311 [0,1,1,0,0,0|2,0,0]=4 352 B14R1.952 O=C(C=CBr)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100016273825 [0,1,1,0,0,0|2,0,0]=4 353 B14R1.952 O=C(C=CCl)Nc1cc(cc(c1)Cl)O 1626a_100000123917_200016279998 [0,1,1,0,0,0|2,0,0]=4 354 B14R1.952 O=C(C=CI)Nc1cc(cc(c1)Cl)O 1626a_100000123917_100016256311 [0,1,1,0,0,0|2,0,0]=4 355 B14R1.962 CC=CC(=O)Cc1cccc(c1)CO 1458a_100000210699_100010188025 [0,1,1,0,0,0|2,0,0]=4 356 B14R1.962 CC=CC(=O)Cc1cccc(c1)OC 1458a_100000210699_100000211672 [0,1,1,0,0,0|2,0,0]=4 357 B14R1.962 CC=CC(=O)Nc1cccc(c1)CO 22a_100000211919_100000210699 [0,1,1,0,0,0|2,0,0]=4 358 B14R1.962 CC=CC(=O)Nc1cccc(c1)OC 11a_100000210024_100000210699 [0,1,1,0,0,0|2,0,0]=4 359 B14R1.962 CC=CC(=O)Nc1cccc(c1)OC 1626a_100000210024_100000210699 [0,1,1,0,0,0|2,0,0]=4 360 B14R1.962 CC=CC(=O)Nc1cccc(c1)OC 22a_100000210024_100000210699 [0,1,1,0,0,0|2,0,0]=4 361 B14R1.962 COc1cccc(c1)CC(=O)C=CBr 1458a_100016273825_100000211672 [0,1,1,0,0,0|2,0,0]=4 362 B14R1.962 COc1cccc(c1)CC(=O)C=CCl 1458a_200016279998_100000211672 [0,1,1,0,0,0|2,0,0]=4 363 B14R1.962 COc1cccc(c1)CC(=O)C=CI 1458a_100016256311_100000211672 [0,1,1,0,0,0|2,0,0]=4 364 B14R1.962 COc1cccc(c1)NC(=O)C=CBr 1626a_100000210024_100016273825 [0,1,1,0,0,0|2,0,0]=4 365 B14R1.962 COc1cccc(c1)NC(=O)C=CCl 11a_100000210024_200016279998 [0,1,1,0,0,0|2,0,0]=4 366 B14R1.962 COc1cccc(c1)NC(=O)C=CCl 1626a_100000210024_200016279998 [0,1,1,0,0,0|2,0,0]=4 367 B14R1.962 COc1cccc(c1)NC(=O)C=CI 1626a_100000210024_100016256311 [0,1,1,0,0,0|2,0,0]=4 368 B14R1.962 O=C(C=CBr)Cc1cccc(c1)CO 1458a_100016273825_100010188025 [0,1,1,0,0,0|2,0,0]=4 369 B14R1.962 O=C(C=CCl)Cc1cccc(c1)CO 1458a_200016279998_100010188025 [0,1,1,0,0,0|2,0,0]=4 370 B14R1.962 O=C(C=CI)Cc1cccc(c1)CO 1458a_100016256311_100010188025 [0,1,1,0,0,0|2,0,0]=4 371 B14R1.967 CC=CC(=O)Nc1ccc(c(c1)O)C 11a_100000759471_100000210699 [0,1,1,0,0,0|2,0,0]=4 372 B14R1.967 CC=CC(=O)Nc1ccc(c(c1)O)C 22a_100000759471_100000210699 [0,1,1,0,0,0|2,0,0]=4 373 B14R1.967 CC=CC(=O)Nc1ccc(c(c1)O)Cl 22a_100011934209_100000210699 [0,1,1,0,0,0|2,0,0]=4 374 B14R1.967 CC=CC(=O)Nc1ccc(c(c1)O)F 22a_100012017398_100000210699 [0,1,1,0,0,0|2,0,0]=4 375 B14R1.967 CC=CC(=O)Nc1ccc(c(c1)O)O 22a_100102946323_100000210699 [0,1,1,0,0,0|2,0,0]=4 376 B14R1.967 Cc1ccc(cc1O)NC(=O)C=CCl 11a_100000759471_200016279998 [0,1,1,0,0,0|2,0,0]=4 377 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)C 1458a_100000211388_100011660834 [0,1,1,0,0,0|2,0,0]=4 378 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)Cl 1458a_200042562850_100011660834 [0,1,1,0,0,0|2,0,0]=4 379 B14R1.5978 CC(=CC(=O)Cc1cccc(c1)O)I 1458a_100025716642_100011660834 [0,1,1,0,0,0|2,0,0]=4 380 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)C 1626a_100000210217_100000211388 [0,1,1,0,0,0|2,0,0]=4 381 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)C 22a_100000210217_100000211388 [0,1,1,0,0,0|2,0,0]=4 382 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)Cl 1626a_100000210217_200042562850 [0,1,1,0,0,0|2,0,0]=4 383 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)Cl 22a_100000210217_200042562850 [0,1,1,0,0,0|2,0,0]=4 384 B14R1.5978 CC(=CC(=O)Nc1cccc(c1)O)I 1626a_100000210217_100025716642 [0,1,1,0,0,0|2,0,0]=4 385 B14R1.5978 O=C(C=C(Cl)Cl)Cc1cccc(c1)O 1458a_100000137448_100011660834 [0,1,1,0,0,0|2,0,0]=4 386 B14R1.5978 O=C(C=C(Cl)Cl)Nc1cccc(c1)O 1626a_100000210217_100000137448 [0,1,1,0,0,0|2,0,0]=4 387 B14R1.10 COC(=O)CC(=O)c1ccc(cc1)O 1458a_100000212099_100000747449 [0,1,1,0,0,0|0,0,2]=4 388 B14R1.10 COC(=O)CC(=O)c1ccc(cc1)O 271570a_203496583355_100014373347 [0,1,1,0,0,0|0,0,2]=4 389 B14R1.10 O=C(CO)CC(=O)c1ccc(cc1)O 1458a_100000210174_100009814261 [0,1,1,0,0,0|0,0,2]=4 390 B14R1.164 C=C(C)c1ccc(cc1OC(=O)C)F 271570a_100000694244_200015685721 [0,1,1,0,0,0|2,0,0]=4 391 B14R1.2523 C/C=C/CC(=O)c1ccc(cc1O)O 1458a_100000212172_100102629194 [0,1,1,0,0,0|1,0,1]=4 392 B14R1.2523 CC=CCC(=O)c1ccc(cc1O)O 1458a_100000212172_100000070051 [0,1,1,0,0,0|1,0,1]=4 393 B14R2.134 C=Cc1ccc2ccc(=O)oc2c1 271570a_100011290941_100009993525 [1,1,0,0,0,0|1,0,0]=3 394 B14R2.134 C=Cc1ccc2ccc(cc2c1)O 271570a_100011290941_100009816537 [1,1,0,0,0,0|2,0,0]=4 395 B14R2.134 C=Cc1ccc2ccc(cc2n1)O 271570a_100011290941_100000079174 [1,1,0,0,0,0|2,0,0]=4 396 B14R2.134 CNc1ccc2ccc(cc2c1)O 34a_100015378740_200000210301 [1,1,0,0,0,0|2,0,0]=4 397 B14R2.134 CNc1ccc2ccc(cc2c1)O 7a_100015378740_200000210301 [1,1,0,0,0,0|2,0,0]=4 398 B14R2.134 COc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200000210301 [1,1,0,0,0,0|0,0,2]=4 399 B14R2.134 COc1ccc2ccc(=O)oc2c1 34a_100000185914_200000210301 [1,1,0,0,0,0|0,0,0]=2 400 B14R2.134 COc1ccc2ccc(=O)oc2c1 7a_100000185914_200000210301 [1,1,0,0,0,0|0,0,0]=2 401 B14R2.134 COc1ccc2ccc(cc2c1)Br 34a_100009816537_200000210301 [1,1,0,0,0,0|2,0,0]=4 402 B14R2.134 COc1ccc2ccc(cc2c1)Br 7a_100009816537_200000210301 [1,1,0,0,0,0|2,0,0]=4 403 B14R2.134 COc1ccc2ccc(cc2c1)C 34a_100000091598_200000210301 [1,1,0,0,0,0|2,0,0]=4 404 B14R2.134 COc1ccc2ccc(cc2c1)C 7a_100000091598_200000210301 [1,1,0,0,0,0|2,0,0]=4 405 B14R2.134 COc1ccc2ccc(cc2c1)N 34a_100015378740_200000210301 [1,1,0,0,0,0|2,0,0]=4 406 B14R2.134 COc1ccc2ccc(cc2c1)N 7a_100015378740_200000210301 [1,1,0,0,0,0|2,0,0]=4 407 B14R2.134 COc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090027 [1,1,0,0,0,0|1,0,1]=4 408 B14R2.134 COc1ccc2ccc(cc2n1)O 271570a_203496583355_100010248626 [1,1,0,0,0,0|1,0,1]=4 409 B14R2.134 COc1ccc2ccc(nc2c1)C 34a_100009867695_200000210301 [1,1,0,0,0,0|2,0,0]=4 410 B14R2.134 COc1ccc2ccc(nc2c1)C 7a_100009867695_200000210301 [1,1,0,0,0,0|2,0,0]=4 411 B14R2.134 COc1ccc2ccc(nc2c1)Cl 34a_100000079174_200000210301 [1,1,0,0,0,0|2,0,0]=4 412 B14R2.134 COc1ccc2ccc(nc2c1)Cl 7a_100000079174_200000210301 [1,1,0,0,0,0|2,0,0]=4 413 B14R2.134 COc1ccc2ccc(nc2c1)O 271570a_203496583355_100009877240 [1,1,0,0,0,0|1,0,1]=4 414 B14R2.134 CSc1ccc2ccc(=O)oc2c1 62a_200000210301_100009993525 [1,1,0,0,0,0|0,1,0]=3 415 B14R2.134 CSc1ccc2ccc(cc2c1)O 62a_200000210301_100009816537 [1,1,0,0,0,0|1,1,0]=4 416 B14R2.134 CSc1ccc2ccc(cc2n1)O 62a_200000210301_100000079174 [1,1,0,0,0,0|1,1,0]=4 417 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 34a_100000091598_200025704644 [1,1,0,0,0,0|2,0,0]=4 418 B14R2.134 Cc1ccc2ccc(cc2c1)O[13CH3] 7a_100000091598_200025704644 [1,1,0,0,0,0|2,0,0]=4 419 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 34a_100009867695_200025704644 [1,1,0,0,0,0|2,0,0]=4 420 B14R2.134 Cc1ccc2ccc(cc2n1)O[13CH3] 7a_100009867695_200025704644 [1,1,0,0,0,0|2,0,0]=4 421 B14R2.134 O=Cc1ccc2ccc(cc2c1)O 271570a_203496583355_100010200085 [1,1,0,0,0,0|1,0,0]=3 422 B14R2.134 O=Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100010174008 [1,1,0,0,0,0|2,0,0]=4 423 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 34a_100015378740_200025704644 [1,1,0,0,0,0|2,0,0]=4 424 B14R2.134 [13CH3]Nc1ccc2ccc(cc2c1)O 7a_100015378740_200025704644 [1,1,0,0,0,0|2,0,0]=4 425 B14R2.134 [13CH3]Oc1ccc2c(c1)OC(=O)CC2 7a_100000044819_200025704644 [1,1,0,0,0,0|0,0,2]=4 426 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 34a_100000185914_200025704644 [1,1,0,0,0,0|0,0,0]=2 427 B14R2.134 [13CH3]Oc1ccc2ccc(=O)oc2c1 7a_100000185914_200025704644 [1,1,0,0,0,0|0,0,0]=2 428 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 34a_100009816537_200025704644 [1,1,0,0,0,0|2,0,0]=4 429 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)Br 7a_100009816537_200025704644 [1,1,0,0,0,0|2,0,0]=4 430 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 34a_100015378740_200025704644 [1,1,0,0,0,0|2,0,0]=4 431 B14R2.134 [13CH3]Oc1ccc2ccc(cc2c1)N 7a_100015378740_200025704644 [1,1,0,0,0,0|2,0,0]=4 432 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 34a_100000079174_200025704644 [1,1,0,0,0,0|2,0,0]=4 433 B14R2.134 [13CH3]Oc1ccc2ccc(nc2c1)Cl 7a_100000079174_200025704644 [1,1,0,0,0,0|2,0,0]=4 434 B14R2.134 [13CH3]Sc1ccc2ccc(=O)oc2c1 62a_200025704644_100009993525 [1,1,0,0,0,0|0,1,0]=3 435 B14R2.134 [13CH3]Sc1ccc2ccc(cc2c1)O 62a_200025704644_100009816537 [1,1,0,0,0,0|1,1,0]=4 436 B14R2.134 [13CH3]Sc1ccc2ccc(cc2n1)O 62a_200025704644_100000079174 [1,1,0,0,0,0|1,1,0]=4 437 B14R2.4513 Cn1c(=O)ccc2c1cc(cc2)O 271570a_203496583355_200010167779 [1,1,0,0,0,0|1,0,0]=3 438 B14R2.4513 Cn1c(=O)cnc2c1cc(cc2)O 271570a_203496583355_100010221214 [1,1,0,0,0,0|2,0,0]=4 439 B14R2.8239 O=c1[nH]c2ccc(cc2[nH]c1=O)O 271570a_203496583355_100011221361 [1,1,0,0,0,0|2,0,0]=4 440 B14R2.8239 Oc1ccc2cc(c(cc2c1)O)O 271570a_203496583355_100010179872 [1,1,0,0,0,0|1,0,1]=4 441 B14R2.8239 Oc1ccc2cc(c(nc2c1)Cl)Br 271570a_203496583355_100135414633 [1,1,0,0,0,0|2,0,0]=4 442 B14R2.1019 C=Cc1cc(c2ccccc2c1)O 271570a_100011290941_100010089979 [1,1,0,0,0,0|2,0,0]=4 443 B14R2.1019 COc1cc(c2ccccc2c1)O 271570a_203496583355_100010152498 [1,1,0,0,0,0|1,0,1]=4 444 B14R2.1019 COc1cc(c2ccccc2n1)O 271570a_203496583355_100009887561 [1,1,0,0,0,0|1,0,1]=4 445 B14R2.1019 CSc1cc(c2ccccc2c1)O 62a_200000210301_100010089979 [1,1,0,0,0,0|1,1,0]=4 446 B14R2.1019 [13CH3]Sc1cc(c2ccccc2c1)O 62a_200025704644_100010089979 [1,1,0,0,0,0|1,1,0]=4 447 B14R2.1146 C=Cc1cc(=O)[nH]c2c1cccc2 271570a_100011290941_100000075698 [1,1,0,0,0,0|2,0,0]=4 448 B14R2.1146 CNc1cc(=O)[nH]c2c1cccc2 27a_100102657272_100000075698 [1,1,0,0,0,0|2,0,0]=4 449 B14R2.1146 COc1cc(cc2c1cccc2)Br 34a_100010089979_200000210301 [1,1,0,0,0,0|2,0,0]=4 450 B14R2.1146 COc1cc(cc2c1cccc2)Br 7a_100010089979_200000210301 [1,1,0,0,0,0|2,0,0]=4 451 B14R2.1146 COc1cc(nc2c1cccc2)C 34a_100000698765_200000210301 [1,1,0,0,0,0|2,0,0]=4 452 B14R2.1146 COc1cc(nc2c1cccc2)O 271570a_203496583355_200010892118 [1,1,0,0,0,0|1,0,1]=4 453 B14R2.1146 CSc1cc(=O)[nH]c2c1cccc2 62a_200000210301_100000075698 [1,1,0,0,0,0|1,1,0]=4 454 B14R2.1146 Cc1cc(c2ccccc2n1)O[13CH3] 34a_100000698765_200025704644 [1,1,0,0,0,0|2,0,0]=4 455 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 34a_100010089979_200025704644 [1,1,0,0,0,0|2,0,0]=4 456 B14R2.1146 [13CH3]Oc1cc(cc2c1cccc2)Br 7a_100010089979_200025704644 [1,1,0,0,0,0|2,0,0]=4 457 B14R2.1146 [13CH3]Sc1cc(=O)[nH]c2c1cccc2 62a_200025704644_100000075698 [1,1,0,0,0,0|1,1,0]=4 458 B14R2.7724 Cn1c(=O)cc(c2c1cccc2)O 271570a_203496583355_100000041018 [1,1,0,0,0,0|1,0,0]=3 459 B14R2.8045 Cc1cc(c2cccc(c2n1)C)O 271570a_203496583355_100000757406 [1,1,0,0,0,0|2,0,0]=4 460 B14R2.8045 Cc1cc(c2cccc(c2n1)F)O 271570a_203496583355_100000689329 [1,1,0,0,0,0|2,0,0]=4 461 B14R2.8045 Cc1cc(c2cccc(c2n1)O)O 271570a_203496583355_200011333620 [1,1,0,0,0,0|2,0,0]=4 462 B14R2.8045 O=c1cc(c2cccc(c2[nH]1)O)O 271570a_203496583355_200010201894 [1,1,0,0,0,0|1,0,0]=3 463 B14R2.8235 Cc1cc(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100009820897 [1,1,0,0,0,0|2,0,0]=4 464 B14R2.8235 Cc1cc(c2cc(ccc2n1)F)O 271570a_203496583355_100000689691 [1,1,0,0,0,0|2,0,0]=4 465 B14R2.8235 Cc1ccc2nc(cc(c2c1)O)C 271570a_203496583355_100011333704 [1,1,0,0,0,0|2,0,0]=4 466 B14R2.8235 O=c1[nH]c(=O)c2cc(ccc2o1)O 271570a_203496583355_200000725568 [1,1,0,0,0,0|1,0,1]=4 467 B14R2.8235 O=c1cc(c2cc(ccc2[nH]1)O)O 271570a_203496583355_100000695641 [1,1,0,0,0,0|1,0,0]=3 468 B14R2.8235 O=c1cc(c2cc(ccc2o1)O)O 271570a_203496583355_100009814091 [1,1,0,0,0,0|0,0,0]=2 469 B14R2.1073 C=Cc1ccnc2c1ccc(c2)O 271570a_100011290941_100000045489 [1,1,0,0,0,0|2,0,0]=4 470 B14R2.1073 CNc1cccc2c1ccc(c2)O 34a_100000034668_200000210301 [1,1,0,0,0,0|2,0,0]=4 471 B14R2.1073 CNc1ccnc2c1ccc(c2)O 27a_100102657272_100000045489 [1,1,0,0,0,0|2,0,0]=4 472 B14R2.1073 COc1cccc2c1ccc(c2)Br 34a_100010202202_200000210301 [1,1,0,0,0,0|2,0,0]=4 473 B14R2.1073 COc1cccc2c1ccc(c2)Br 7a_100010202202_200000210301 [1,1,0,0,0,0|2,0,0]=4 474 B14R2.1073 COc1cccc2c1ccc(c2)F 34a_100009846233_200000210301 [1,1,0,0,0,0|2,0,0]=4 475 B14R2.1073 COc1cccc2c1ccc(c2)F 7a_100009846233_200000210301 [1,1,0,0,0,0|2,0,0]=4 476 B14R2.1073 COc1cccc2c1ccc(c2)N 34a_100000035793_200000210301 [1,1,0,0,0,0|2,0,0]=4 477 B14R2.1073 COc1cccc2c1ccc(n2)O 271570a_203496583355_100010382897 [1,1,0,0,0,0|2,0,0]=4 478 B14R2.1073 COc1ccnc2c1ccc(c2)Cl 34a_100011215206_200000210301 [1,1,0,0,0,0|2,0,0]=4 479 B14R2.1073 COc1ccnc2c1ccc(c2)F 34a_100000004115_200000210301 [1,1,0,0,0,0|2,0,0]=4 480 B14R2.1073 COc1ccnc2c1ccc(c2)O 271570a_203496583355_100010204255 [1,1,0,0,0,0|1,0,0]=3 481 B14R2.1073 COc1ncnc2c1ccc(c2)O 271570a_203496583355_100134615805 [1,1,0,0,0,0|2,0,0]=4 482 B14R2.1073 CSc1ccnc2c1ccc(c2)O 62a_200000210301_100000045489 [1,1,0,0,0,0|1,1,0]=4 483 B14R2.1073 [13CH3]Nc1cccc2c1ccc(c2)O 34a_100000034668_200025704644 [1,1,0,0,0,0|2,0,0]=4 484 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 34a_100010202202_200025704644 [1,1,0,0,0,0|2,0,0]=4 485 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)Br 7a_100010202202_200025704644 [1,1,0,0,0,0|2,0,0]=4 486 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 34a_100009846233_200025704644 [1,1,0,0,0,0|2,0,0]=4 487 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)F 7a_100009846233_200025704644 [1,1,0,0,0,0|2,0,0]=4 488 B14R2.1073 [13CH3]Oc1cccc2c1ccc(c2)N 34a_100000035793_200025704644 [1,1,0,0,0,0|2,0,0]=4 489 B14R2.1073 [13CH3]Oc1ccnc2c1ccc(c2)Cl 34a_100011215206_200025704644 [1,1,0,0,0,0|2,0,0]=4 490 B14R2.1073 [13CH3]Oc1ccnc2c1ccc(c2)F 34a_100000004115_200025704644 [1,1,0,0,0,0|2,0,0]=4 491 B14R2.1073 [13CH3]Sc1ccnc2c1ccc(c2)O 62a_200025704644_100000045489 [1,1,0,0,0,0|1,1,0]=4 492 B14R2.1801 C=Cc1ccc2c(=O)ccoc2c1 271570a_100011290941_100010062221 [1,1,0,0,0,0|1,0,1]=4 493 B14R2.1801 C=Cc1ccc2c(cccc2c1)O 271570a_100011290941_100010202202 [1,1,0,0,0,0|2,0,0]=4 494 B14R2.1801 C=Cc1ccc2c(ccnc2c1)O 271570a_100011290941_100000756855 [1,1,0,0,0,0|2,0,0]=4 495 B14R2.1801 CNc1ccc2c(cccc2c1)O 34a_100000035793_200000210301 [1,1,0,0,0,0|2,0,0]=4 496 B14R2.1801 CNc1ccc2c(cccc2c1)O 7a_100000035793_200000210301 [1,1,0,0,0,0|2,0,0]=4 497 B14R2.1801 COc1ccc2c(=O)ccoc2c1 34a_200000065989_200000210301 [1,1,0,0,0,0|0,0,1]=3 498 B14R2.1801 COc1ccc2c(=O)ccoc2c1 7a_200000065989_200000210301 [1,1,0,0,0,0|0,0,1]=3 499 B14R2.1801 COc1ccc2c(cccc2c1)N 34a_100000034668_200000210301 [1,1,0,0,0,0|2,0,0]=4 500 B14R2.1801 COc1ccc2c(cccc2c1)N 7a_100000034668_200000210301 [1,1,0,0,0,0|2,0,0]=4 501 B14R2.1801 COc1ccc2c(cccc2c1)O 271570a_203496583355_100010151670 [1,1,0,0,0,0|1,0,0]=3 502 B14R2.1801 COc1ccc2c(ccnc2c1)Br 34a_100010204257_200000210301 [1,1,0,0,0,0|2,0,0]=4 503 B14R2.1801 COc1ccc2c(ccnc2c1)Br 7a_100010204257_200000210301 [1,1,0,0,0,0|2,0,0]=4 504 B14R2.1801 COc1ccc2c(ccnc2c1)C 34a_200009854145_200000210301 [1,1,0,0,0,0|2,0,0]=4 505 B14R2.1801 COc1ccc2c(ccnc2c1)C 7a_200009854145_200000210301 [1,1,0,0,0,0|2,0,0]=4 506 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 34a_100000045489_200000210301 [1,1,0,0,0,0|2,0,0]=4 507 B14R2.1801 COc1ccc2c(ccnc2c1)Cl 7a_100000045489_200000210301 [1,1,0,0,0,0|2,0,0]=4 508 B14R2.1801 COc1ccc2c(ccnc2c1)O 271570a_203496583355_100000045488 [1,1,0,0,0,0|1,0,0]=3 509 B14R2.1801 COc1ccc2c(nccc2c1)O 271570a_203496583355_100000084302 [1,1,0,0,0,0|2,0,0]=4 510 B14R2.1801 COc1ccc2c(ncnc2c1)O 271570a_203496583355_100011248138 [1,1,0,0,0,0|2,0,0]=4 511 B14R2.1801 COc1cnc2c(ccnc2c1)O 271570a_203496583355_100009875103 [1,1,0,0,0,0|2,0,0]=4 512 B14R2.1801 CSc1ccc2c(=O)ccoc2c1 62a_200000210301_100010062221 [1,1,0,0,0,0|0,1,1]=4 513 B14R2.1801 CSc1ccc2c(cccc2c1)O 62a_200000210301_100010202202 [1,1,0,0,0,0|1,1,0]=4 514 B14R2.1801 CSc1ccc2c(ccnc2c1)O 62a_200000210301_100000756855 [1,1,0,0,0,0|1,1,0]=4 515 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 34a_200009854145_200025704644 [1,1,0,0,0,0|2,0,0]=4 516 B14R2.1801 Cc1ccnc2c1ccc(c2)O[13CH3] 7a_200009854145_200025704644 [1,1,0,0,0,0|2,0,0]=4 517 B14R2.1801 N#Cc1ccc2c(cccc2c1)O 271570a_203496583355_100010090035 [1,1,0,0,0,0|2,0,0]=4 518 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 34a_100000035793_200025704644 [1,1,0,0,0,0|2,0,0]=4 519 B14R2.1801 [13CH3]Nc1ccc2c(cccc2c1)O 7a_100000035793_200025704644 [1,1,0,0,0,0|2,0,0]=4 520 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 34a_200000065989_200025704644 [1,1,0,0,0,0|0,0,1]=3 521 B14R2.1801 [13CH3]Oc1ccc2c(=O)ccoc2c1 7a_200000065989_200025704644 [1,1,0,0,0,0|0,0,1]=3 522 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 34a_100000034668_200025704644 [1,1,0,0,0,0|2,0,0]=4 523 B14R2.1801 [13CH3]Oc1ccc2c(cccc2c1)N 7a_100000034668_200025704644 [1,1,0,0,0,0|2,0,0]=4 524 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 34a_100010204257_200025704644 [1,1,0,0,0,0|2,0,0]=4 525 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Br 7a_100010204257_200025704644 [1,1,0,0,0,0|2,0,0]=4 526 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 34a_100000045489_200025704644 [1,1,0,0,0,0|2,0,0]=4 527 B14R2.1801 [13CH3]Oc1ccc2c(ccnc2c1)Cl 7a_100000045489_200025704644 [1,1,0,0,0,0|2,0,0]=4 528 B14R2.1801 [13CH3]Sc1ccc2c(=O)ccoc2c1 62a_200025704644_100010062221 [1,1,0,0,0,0|0,1,1]=4 529 B14R2.1801 [13CH3]Sc1ccc2c(cccc2c1)O 62a_200025704644_100010202202 [1,1,0,0,0,0|1,1,0]=4 530 B14R2.1801 [13CH3]Sc1ccc2c(ccnc2c1)O 62a_200025704644_100000756855 [1,1,0,0,0,0|1,1,0]=4 531 B14R2.8038 Cc1c(ccc2c1nccc2O)F 271570a_203496583355_100011516163 [1,1,0,0,0,0|2,0,0]=4 532 B14R2.8038 Cc1ccc2c(ccnc2c1C)O 271570a_203496583355_100011310510 [1,1,0,0,0,0|2,0,0]=4 533 B14R2.8038 O=c1cc[nH]c2c1ccc(c2F)O 271570a_203496583355_100022010583 [1,1,0,0,0,0|1,0,1]=4 534 B14R2.29369 O=C1C=Cc2cc(ccc2C1=O)O 271570a_203496583355_100009812793 [1,1,0,0,0,0|1,0,1]=4 535 B14R2.29369 Oc1ccc2c(c(ccc2c1)O)F 271570a_203496583355_100010730138 [1,1,0,0,0,0|2,0,0]=4 536 B14R2.1812 COc1ccc2c(c1)C(=O)NC2=O 7a_100000101950_200000210301 [0,1,0,0,1,0|1,0,1]=4 537 B14R2.1812 COc1ccc2c(c1)C(=O)OC2=O 7a_100000030292_200000210301 [0,1,0,0,1,0|1,0,1]=4 538 B14R2.1812 [13CH3]Oc1ccc2c(c1)C(=O)NC2=O 7a_100000101950_200025704644 [0,1,0,0,1,0|1,0,1]=4 539 B14R2.1812 [13CH3]Oc1ccc2c(c1)C(=O)OC2=O 7a_100000030292_200025704644 [0,1,0,0,1,0|1,0,1]=4 540 B14R2.8716 CN1C(=O)C(=O)c2c1ccc(c2)O 271570a_203496583355_100000187606 [0,1,0,0,1,0|2,0,0]=4 541 B14R2.8716 CN1C(=O)c2ccc(cc2C1=O)O 271570a_203496583355_200009814873 [0,1,0,0,1,0|1,0,1]=4 542 B14R2.45178 Cn1cc(c2c1ccc(c2)O)C=O 271570a_203496583355_100009812439 [0,1,0,0,1,0|2,0,0]=4 543 B14R2.8737 O=C1Nc2c(ccc(c2F)O)C1=O 271570a_203496583355_100011000547 [0,1,0,0,1,0|1,0,1]=4 544 B16R2.7927 COc1ccc2c(cc(=O)oc2c1)CCl 7a_100000010346_200000210301 [0,2,0,0,0,0|1,0,0]=3 545 B16R2.7927 [13CH3]Oc1ccc2c(cc(=O)oc2c1)CCl 7a_100000010346_200025704644 [0,2,0,0,0,0|1,0,0]=3 546 B16R2.113313 CCOc1cc(=O)oc2c1ccc(c2)Br 7a_100010062223_100000210202 [0,2,0,0,0,0|1,0,0]=3 547 B16R2.113313 CCOc1cc(=O)oc2c1ccc(c2)F 7a_100009876825_100000210202 [0,2,0,0,0,0|1,0,0]=3 548 B16R2.113313 CNCc1cc(=O)oc2c1ccc(c2)O 2230a_106832991635_100000010346 [0,2,0,0,0,0|1,0,0]=3 549 B16R2.113313 CNCc1cc(=O)oc2c1ccc(c2)O 7a_106832991635_100000010346 [0,2,0,0,0,0|1,0,0]=3 550 B16R2.113313 CSCc1cc(=O)oc2c1ccc(c2)O 62a_200000210301_100000010346 [0,2,0,0,0,0|0,1,0]=3 551 B16R2.113313 O=c1cc(c2ccc(cc2o1)Br)OCF 7a_100010062223_100015361967 [0,2,0,0,0,0|1,0,0]=3 552 B16R2.113313 O=c1cc(c2ccc(cc2o1)F)OCF 7a_100009876825_100015361967 [0,2,0,0,0,0|1,0,0]=3 553 B16R2.113313 [13CH3]SCc1cc(=O)oc2c1ccc(c2)O 62a_200025704644_100000010346 [0,2,0,0,0,0|0,1,0]=3 554 B16R2.198795 COc1cc(=O)oc2c1cc(c(c2)C)C 7a_200000066588_200000210301 [0,2,0,0,0,0|1,0,0]=3 555 B16R2.198795 Cc1cc2oc(=O)cc(c2cc1C)O[13CH3] 7a_200000066588_200025704644 [0,2,0,0,0,0|1,0,0]=3 556 B16R2.41208 CNc1cc2c(cc(=O)oc2cc1C)C 7a_200000066935_200000210301 [0,2,0,0,0,0|2,0,0]=4 557 B16R2.41208 Cc1cc2oc(=O)cc(c2cc1N[13CH3])C 7a_200000066935_200025704644 [0,2,0,0,0,0|2,0,0]=4 558 B16R2.192589 COc1cc2oc(=O)cc(c2cc1Cl)C 7a_100000010825_200000210301 [0,2,0,0,0,0|1,0,0]=3 559 B16R2.192589 Cc1cc(=O)oc2c1cc(c(c2)O[13CH3])Cl 7a_100000010825_200025704644 [0,2,0,0,0,0|1,0,0]=3 560 B16R2.8632 C=Cc1c(c2ccc(cc2oc1=O)O)C 271570a_100011290941_200009996780 [0,2,0,0,0,0|1,0,0]=3 561 B16R2.8632 CSc1c(c2ccc(cc2oc1=O)O)C 62a_200000210301_200009996780 [0,2,0,0,0,0|1,0,0]=3 562 B16R2.8632 Cc1c(c(=O)oc2c1ccc(c2)O)S[13CH3] 62a_200025704644_200009996780 [0,2,0,0,0,0|1,0,0]=3 563 B16R2.197061 COc1ccc2c(c(c(=O)oc2c1)Br)C 7a_200009996780_200000210301 [0,2,0,0,0,0|1,0,0]=3 564 B16R2.197061 COc1ccc2c(c(c(=O)oc2c1)Cl)C 7a_100000212122_200000210301 [0,2,0,0,0,0|1,0,0]=3 565 B16R2.197061 Cc1c(c(=O)oc2c1ccc(c2)O[13CH3])Br 7a_200009996780_200025704644 [0,2,0,0,0,0|1,0,0]=3 566 B16R2.197061 Cc1c(c(=O)oc2c1ccc(c2)O[13CH3])Cl 7a_100000212122_200025704644 [0,2,0,0,0,0|1,0,0]=3 567 B16R2.197098 COc1ccc2c(cc(=O)oc2c1N)C 7a_200000009704_200000210301 [0,2,0,0,0,0|1,0,0]=3 568 B16R2.197098 Cc1cc(=O)oc2c1ccc(c2N)O[13CH3] 7a_200000009704_200025704644 [0,2,0,0,0,0|1,0,0]=3 569 B16R2.26103 C=C(C)c1ccc2c(cc(=O)oc2c1)O 271570a_100000694244_100010062223 [0,2,0,0,0,0|1,0,0]=3 570 B16R2.150515 C=C=Cc1ccc2c(cc(=O)oc2c1)O 271570a_100015277604_100010062223 [0,2,0,0,0,0|1,0,0]=3 571 B16R2.150515 CC=Cc1ccc2c(cc(=O)oc2c1)O 271570a_100016259895_100010062223 [0,2,0,0,0,0|1,0,0]=3 572 B16R2.150515 CCNc1ccc2c(cc(=O)oc2c1)C 7a_100000010859_100000210202 [0,2,0,0,0,0|2,0,0]=4 573 B16R2.150515 CCOc1ccc2c(cc(=O)oc2c1)C 34a_100000181958_100000210202 [0,2,0,0,0,0|1,0,0]=3 574 B16R2.150515 CCOc1ccc2c(cc(=O)oc2c1)C 7a_100000181958_100000210202 [0,2,0,0,0,0|1,0,0]=3 575 B16R2.150515 CCSc1ccc2c(cc(=O)oc2c1)O 62a_100000210202_100010062223 [0,2,0,0,0,0|0,1,0]=3 576 B16R2.150515 Cc1cc(=O)oc2c1ccc(c2)NCF 7a_100000010859_100015361967 [0,2,0,0,0,0|2,0,0]=4 577 B16R2.150515 Cc1cc(=O)oc2c1ccc(c2)OCF 34a_100000181958_100015361967 [0,2,0,0,0,0|1,0,0]=3 578 B16R2.150515 Cc1cc(=O)oc2c1ccc(c2)OCF 7a_100000181958_100015361967 [0,2,0,0,0,0|1,0,0]=3 579 B16R2.150515 O=c1cc(c2ccc(cc2o1)SCF)O 62a_100015361967_100010062223 [0,2,0,0,0,0|0,1,0]=3 580 B14R2.716 Oc1cccc(c1)Sc2ccoc2 62a_100011215275_100000211634 [0,0,1,1,0,0|1,1,0]=4 581 B14R2.716 Oc1cccc(c1)Sc2ccon2 62a_100009818083_100000211634 [0,0,1,1,0,0|1,1,0]=4 582 B14R2.20 Nc1cc(no1)c2ccc(cc2)O 271570a_203496583355_100000238412 [0,0,1,1,0,0|2,0,0]=4 583 B14R2.20 O=C1C=C(CC1)c2ccc(cc2)O 271570a_100010737933_100000185759 [0,0,1,1,0,0|2,0,0]=4 584 B14R2.20 O=c1[nH]c(no1)c2ccc(cc2)O 271570a_203496583355_100011388237 [0,0,1,1,0,0|2,0,0]=4 585 B14R2.739 Cc1cc(ccc1c2ccco2)O 271570a_100000040639_100009814098 [0,0,1,1,0,0|2,0,0]=4 586 B14R2.739 Cc1cc(ccc1c2ccco2)O 271570a_100000750936_100000729255 [0,0,1,1,0,0|2,0,0]=4 587 B14R2.739 Cc1ccc(c(c1)O)c2ccco2 271570a_100000750936_100012002257 [0,0,1,1,0,0|2,0,0]=4 588 B14R2.739 Nc1cc(ccc1c2ccco2)O 271570a_100000750936_100011999798 [0,0,1,1,0,0|2,0,0]=4 589 B14R2.739 Oc1cc(ccc1c2ccco2)Br 271570a_100000750936_100012344904 [0,0,1,1,0,0|2,0,0]=4 590 B14R2.739 Oc1cc(ccc1c2ccco2)Cl 271570a_100000750936_100000050036 [0,0,1,1,0,0|2,0,0]=4 591 B14R2.739 Oc1cc(ccc1c2ccco2)Cl 271570a_100010081499_100009814098 [0,0,1,1,0,0|2,0,0]=4 592 B14R2.739 Oc1cc(ccc1c2ccco2)F 271570a_100000750936_100000690578 [0,0,1,1,0,0|2,0,0]=4 593 B14R2.739 Oc1cc(ccc1c2ccco2)F 271570a_100010081493_100009814098 [0,0,1,1,0,0|2,0,0]=4 594 B14R2.739 Oc1ccc(c(c1)Br)c2ccco2 271570a_100000750936_100000701344 [0,0,1,1,0,0|2,0,0]=4 595 B14R2.739 Oc1ccc(c(c1)Cl)c2ccco2 271570a_100000079644_100009814098 [0,0,1,1,0,0|2,0,0]=4 596 B14R2.739 Oc1ccc(c(c1)Cl)c2ccco2 271570a_100000750936_100000047559 [0,0,1,1,0,0|2,0,0]=4 597 B14R2.739 Oc1ccc(c(c1)F)c2ccco2 271570a_100000750936_100000755031 [0,0,1,1,0,0|2,0,0]=4 598 B14R2.739 Oc1ccc(c(c1)F)c2ccco2 271570a_100009854227_100009814098 [0,0,1,1,0,0|2,0,0]=4 599 B14R2.739 Oc1ccc(c(c1)O)c2cc[nH]c2 271570a_100000102155_100009813921 [0,0,1,1,0,0|2,0,0]=4 600 B14R2.739 Oc1ccc(c(c1)O)c2cc[nH]n2 271570a_100000062414_100009813921 [0,0,1,1,0,0|2,0,0]=4 601 B14R2.739 Oc1ccc(c(c1)O)c2ccco2 271570a_100000750936_100009813921 [0,0,1,1,0,0|1,0,0]=3 602 B14R2.739 Oc1ccc(c(c1)O)c2cccs2 271570a_100000742291_100009813921 [0,0,1,1,0,0|1,1,0]=4 603 B14R2.739 Oc1ccc(c(c1)O)c2ccoc2 271570a_100011218838_100009813921 [0,0,1,1,0,0|1,0,1]=4 604 B14R2.739 Oc1ccc(c(c1)O)c2ccsc2 271570a_100011934443_100009813921 [0,0,1,1,0,0|1,1,0]=4 605 B12R1.17 C=CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210623 [0,0,1,0,1,0|1,0,1]=4 606 B12R1.17 O=C(CCO)c1cccc(c1)O 1458a_100000183914_100000211926 [0,0,1,0,1,0|0,0,2]=4 607 B12R1.20 CC(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200000210301 [0,0,1,0,1,0|1,0,1]=4 608 B12R1.20 NC(=O)C(=O)c1ccc(cc1)O 271570a_203496583355_200009822167 [0,0,1,0,1,0|1,0,1]=4 609 B12R1.20 [13CH3]C(=O)C(O)c1ccc(cc1)O 1458a_100011215213_200025704644 [0,0,1,0,1,0|1,0,1]=4 610 B12R1.46 C=C(C)c1cc(ccc1C=O)O 271570a_100000694244_100011236494 [0,0,1,0,1,0|1,0,1]=4 611 B12R1.46 C=C(C)c1cc(ccc1CO)O 271570a_100000694244_100010146404 [0,0,1,0,1,0|1,0,1]=4 612 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [1,0,0,0,1,0|2,0,0]=4 613 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [1,0,0,0,1,0|2,0,0]=4 614 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [1,0,0,0,1,0|2,0,0]=4 615 B12R2.132 Cn1ccc2c1cc(cc2)O 271570a_203496583355_100011934912 [1,0,0,0,1,0|2,0,0]=4 616 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [1,0,0,0,1,0|0,0,2]=4 617 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [1,0,0,0,1,0|1,0,1]=4 618 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [1,0,0,0,1,0|1,0,1]=4 619 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [1,0,0,0,1,0|1,0,1]=4 620 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [1,0,0,0,1,0|2,0,0]=4 621 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [1,0,0,0,1,0|2,0,0]=4 622 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [1,0,0,0,1,0|2,0,0]=4 623 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [1,0,0,0,1,0|2,0,0]=4 624 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [1,0,0,0,1,0|2,0,0]=4 625 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [1,0,0,0,1,0|2,0,0]=4 626 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [1,0,0,0,1,0|1,0,1]=4 627 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [1,0,0,0,1,0|1,0,1]=4 628 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [1,0,0,0,1,0|2,0,0]=4 629 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [1,0,0,0,1,0|2,0,0]=4 630 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [1,0,0,0,1,0|2,0,0]=4 631 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [1,0,0,0,1,0|1,0,0]=3 632 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [1,0,0,0,1,0|1,1,0]=4 633 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [1,0,0,0,1,0|2,0,0]=4 634 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [1,0,0,0,1,0|1,0,0]=3 635 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [1,0,0,0,1,0|1,1,0]=4 636 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [1,0,0,0,1,0|2,0,0]=4 637 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [1,0,0,0,1,0|1,0,0]=3 638 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [1,0,0,0,1,0|2,0,0]=4 639 B12R2.612 Cn1ccc2c1ccc(c2)O 271570a_203496583355_100011202928 [1,0,0,0,1,0|2,0,0]=4 640 B12R2.612 Nc1noc2c1ccc(c2)O 271570a_203496583355_100012356334 [1,0,0,0,1,0|2,0,0]=4 641 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [1,0,0,0,1,0|0,0,1]=3 642 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [1,0,0,0,1,0|0,0,2]=4 643 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [1,0,0,0,1,0|1,0,0]=3 644 B14R1.32 CC=CC(=O)NCc1cccc(c1)O 240690a_100000743036_100000210699 [0,0,1,0,0,1|2,0,0]=4 645 B14R1.32 O=C(C=CBr)NCc1cccc(c1)O 240690a_100000743036_100016273825 [0,0,1,0,0,1|2,0,0]=4 646 B14R1.32 O=C(C=CCl)NCc1cccc(c1)O 240690a_100000743036_200016279998 [0,0,1,0,0,1|2,0,0]=4 647 B14R1.6823 CC=CC(=O)Nc1ccc(cc1O)O 22a_100000106777_100000210699 [0,0,1,0,0,1|1,0,1]=4