0 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,0,0|3,0,0]=3 1 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [0,0,0,0,0,0|3,0,0]=3 2 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [0,0,0,0,0,0|3,0,0]=3 3 B11R2.1 Oc1c[nH]c2c1cncn2 271570a_203496583355_100009817560 [0,0,0,0,0,0|4,0,0]=4 4 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [0,0,0,0,0,0|3,0,0]=3 5 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [0,0,0,0,0,0|3,0,0]=3 6 B11R2.1 Oc1cnc2n1cccn2 271570a_203496583355_100011934454 [0,0,0,0,0,0|4,0,0]=4 7 B11R2.1 Oc1cnc2n1ccnc2 271570a_203496583355_100011934586 [0,0,0,0,0,0|4,0,0]=4 8 B11R2.1 Oc1cnc2n1nccc2 271570a_203496583355_100009819068 [0,0,0,0,0,0|4,0,0]=4 9 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [0,0,0,0,0,0|3,0,0]=3 10 B11R2.1 Oc1cnn2c1cncc2 271570a_203496583355_100010892148 [0,0,0,0,0,0|4,0,0]=4 11 B11R2.1 Oc1cnn2c1nccc2 271570a_203496583355_100009819579 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,0,0,0|1,0,0]=1 13 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [0,0,0,0,0,0|2,0,0]=2 14 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,0,0,0|1,1,0]=2 15 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,0,0|2,1,0]=3 16 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [0,0,0,0,0,0|2,1,0]=3 17 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [0,0,0,0,0,0|2,1,0]=3 18 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [0,0,0,0,0,0|2,1,0]=3 19 B11R2.1 Oc1csc2c1nccn2 271570a_203496583355_100010174841 [0,0,0,0,0,0|3,1,0]=4 20 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [0,0,0,0,0,0|1,0,0]=1 21 B11R2.1 Oc1n[nH]c2c1cccn2 271570a_203496583355_100009888962 [0,0,0,0,0,0|2,0,0]=2 22 B11R2.1 Oc1n[nH]c2c1ccnc2 271570a_203496583355_100010244369 [0,0,0,0,0,0|2,0,0]=2 23 B11R2.1 Oc1n[nH]c2c1cncc2 271570a_203496583355_100010724670 [0,0,0,0,0,0|2,0,0]=2 24 B11R2.1 Oc1n[nH]c2c1cncn2 271570a_203496583355_100009875510 [0,0,0,0,0,0|3,0,0]=3 25 B11R2.1 Oc1n[nH]c2c1nccc2 271570a_203496583355_100009817118 [0,0,0,0,0,0|2,0,0]=2 26 B11R2.1 Oc1n[nH]c2c1nccn2 271570a_203496583355_100009819591 [0,0,0,0,0,0|3,0,0]=3 27 B11R2.1 Oc1ncn2c1cccc2 271570a_203496583355_100000688344 [0,0,0,0,0,0|2,0,0]=2 28 B11R2.1 Oc1nnc2n1cccc2 271570a_203496583355_100000699609 [0,0,0,0,0,0|2,0,0]=2 29 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [0,1,0,0,0,0|2,0,0]=3 30 B12R2.1 C=Cc1coc2c1nccc2 271570a_100011290941_100009889148 [0,1,0,0,0,0|3,0,0]=4 31 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [0,1,0,0,0,0|2,1,0]=4 32 B12R2.1 C=Cc1n[nH]c2c1cccc2 271570a_100011290941_100000050141 [0,1,0,0,0,0|2,0,0]=3 33 B12R2.1 C=Cc1n[nH]c2c1cccn2 271570a_100011290941_100009888962 [0,1,0,0,0,0|3,0,0]=4 34 B12R2.1 C=Cc1n[nH]c2c1ccnc2 271570a_100011290941_100010244369 [0,1,0,0,0,0|3,0,0]=4 35 B12R2.1 C=Cc1n[nH]c2c1cncc2 271570a_100011290941_100010724670 [0,1,0,0,0,0|3,0,0]=4 36 B12R2.1 C=Cc1n[nH]c2c1nccc2 271570a_100011290941_100009817118 [0,1,0,0,0,0|3,0,0]=4 37 B12R2.1 C=Cc1ncn2c1cccc2 271570a_100011290941_100000688344 [0,1,0,0,0,0|3,0,0]=4 38 B12R2.1 C=Cc1nnc2n1cccc2 271570a_100011290941_100000699609 [0,1,0,0,0,0|3,0,0]=4 39 B12R2.1 CNC1COc2c1cccc2 2230a_100000747519_200000210301 [0,1,0,0,0,0|2,0,1]=4 40 B12R2.1 CNc1n[nH]c2c1cccn2 27a_100102657272_100009818534 [0,1,0,0,0,0|3,0,0]=4 41 B12R2.1 CNc1n[nH]c2c1cncc2 27a_100102657272_100009820117 [0,1,0,0,0,0|3,0,0]=4 42 B12R2.1 CNc1n[nH]c2c1nccc2 27a_100102657272_100009817118 [0,1,0,0,0,0|3,0,0]=4 43 B12R2.1 COC1CCc2c1cccc2 34a_100000212247_200000210301 [0,1,0,0,0,0|2,0,1]=4 44 B12R2.1 COC1CCc2c1cccc2 7a_100000212247_200000210301 [0,1,0,0,0,0|2,0,1]=4 45 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,0,0,0|1,1,0]=3 46 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,0,0,0|1,1,0]=3 47 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,0,0,0|1,1,0]=3 48 B12R2.1 CSc1coc2c1nccc2 62a_200000210301_100009889148 [0,1,0,0,0,0|2,1,0]=4 49 B12R2.1 CSc1csc2c1cccc2 62a_200000210301_100009813928 [0,1,0,0,0,0|1,2,0]=4 50 B12R2.1 CSc1n[nH]c2c1cccc2 62a_200000210301_100000050141 [0,1,0,0,0,0|1,1,0]=3 51 B12R2.1 CSc1n[nH]c2c1cccn2 62a_200000210301_100009888962 [0,1,0,0,0,0|2,1,0]=4 52 B12R2.1 CSc1n[nH]c2c1ccnc2 62a_200000210301_100010244369 [0,1,0,0,0,0|2,1,0]=4 53 B12R2.1 CSc1n[nH]c2c1cncc2 62a_200000210301_100009820117 [0,1,0,0,0,0|2,1,0]=4 54 B12R2.1 CSc1n[nH]c2c1nccc2 62a_200000210301_100009817118 [0,1,0,0,0,0|2,1,0]=4 55 B12R2.1 CSc1ncn2c1cccc2 62a_200000210301_100010892795 [0,1,0,0,0,0|2,1,0]=4 56 B12R2.1 CSc1nnc2n1cccc2 62a_100000699609_200000210301 [0,1,0,0,0,0|2,1,0]=4 57 B12R2.1 CSc1nnc2n1cccc2 62a_200000210301_100000699609 [0,1,0,0,0,0|2,1,0]=4 58 B12R2.1 CSc1noc2c1cccc2 62a_200000210301_200000703156 [0,1,0,0,0,0|0,1,0]=2 59 B12R2.1 CSc1noc2c1cccc2 62a_200000703156_200000210301 [0,1,0,0,0,0|0,1,0]=2 60 B12R2.1 [13CH3]NC1COc2c1cccc2 2230a_100000747519_200025704644 [0,1,0,0,0,0|2,0,1]=4 61 B12R2.1 [13CH3]OC1CCc2c1cccc2 34a_100000212247_200025704644 [0,1,0,0,0,0|2,0,1]=4 62 B12R2.1 [13CH3]OC1CCc2c1cccc2 7a_100000212247_200025704644 [0,1,0,0,0,0|2,0,1]=4 63 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,0,0,0|1,1,0]=3 64 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,0,0,0|1,1,0]=3 65 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,0,0,0|1,1,0]=3 66 B12R2.1 [13CH3]Sc1coc2c1nccc2 62a_200025704644_100009889148 [0,1,0,0,0,0|2,1,0]=4 67 B12R2.1 [13CH3]Sc1csc2c1cccc2 62a_200025704644_100009813928 [0,1,0,0,0,0|1,2,0]=4 68 B12R2.1 [13CH3]Sc1n[nH]c2c1cccc2 62a_200025704644_100000050141 [0,1,0,0,0,0|1,1,0]=3 69 B12R2.1 [13CH3]Sc1n[nH]c2c1cccn2 62a_200025704644_100009888962 [0,1,0,0,0,0|2,1,0]=4 70 B12R2.1 [13CH3]Sc1n[nH]c2c1ccnc2 62a_200025704644_100010244369 [0,1,0,0,0,0|2,1,0]=4 71 B12R2.1 [13CH3]Sc1n[nH]c2c1cncc2 62a_200025704644_100009820117 [0,1,0,0,0,0|2,1,0]=4 72 B12R2.1 [13CH3]Sc1n[nH]c2c1nccc2 62a_200025704644_100009817118 [0,1,0,0,0,0|2,1,0]=4 73 B12R2.1 [13CH3]Sc1ncn2c1cccc2 62a_200025704644_100010892795 [0,1,0,0,0,0|2,1,0]=4 74 B12R2.1 [13CH3]Sc1nnc2n1cccc2 62a_100000699609_200025704644 [0,1,0,0,0,0|2,1,0]=4 75 B12R2.1 [13CH3]Sc1nnc2n1cccc2 62a_200025704644_100000699609 [0,1,0,0,0,0|2,1,0]=4 76 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200000703156_200025704644 [0,1,0,0,0,0|0,1,0]=2 77 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200025704644_200000703156 [0,1,0,0,0,0|0,1,0]=2 78 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,0,0|2,1,0]=4 79 B12R2.18 Cc1nc2ccccn2c1O 271570a_203496583355_100009816614 [0,1,0,0,0,0|3,0,0]=4 80 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,0,0|1,0,0]=2 81 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,0,0|1,1,0]=3 82 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,1,0,0,0,0|1,0,1]=3 83 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,0,0,0|3,0,0]=4 84 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,1,0,0,0,0|1,0,0]=2 85 B12R2.132 Cc1ccc2ncc(n2c1)O 271570a_203496583355_100012351729 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.132 Cc1cnc2[nH]cc(c2c1)O 271570a_203496583355_100010246215 [0,1,0,0,0,0|3,0,0]=4 87 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,0,0,0|2,0,0]=3 88 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,0,0,0|2,1,0]=4 89 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,1,0,0,0,0|2,0,0]=3 90 B12R2.132 Cc1n[nH]c2c1cc(cn2)O 271570a_203496583355_100009814706 [0,1,0,0,0,0|3,0,0]=4 91 B12R2.132 Cc1n[nH]c2c1cc(nc2)O 271570a_203496583355_100102524920 [0,1,0,0,0,0|3,0,0]=4 92 B12R2.132 Cc1nnc2n1cc(cc2)O 271570a_203496583355_100000764415 [0,1,0,0,0,0|3,0,0]=4 93 B12R2.132 Cc1noc2c1cc(cc2)O 271570a_203496583355_100010196875 [0,1,0,0,0,0|1,0,0]=2 94 B12R2.132 Cn1ncc2c1cc(cc2)O 271570a_203496583355_100009817177 [0,1,0,0,0,0|3,0,0]=4 95 B12R2.132 Cn1nnc2c1cc(cc2)O 271570a_203496583355_100010241234 [0,1,0,0,0,0|3,0,0]=4 96 B12R2.132 Nc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353729 [0,1,0,0,0,0|1,0,0]=2 97 B12R2.132 Nc1ccc2ncc(n2c1)O 271570a_203496583355_102495324787 [0,1,0,0,0,0|3,0,0]=4 98 B12R2.132 Nc1ccc2scc(c2c1)O 271570a_203496583355_100011178648 [0,1,0,0,0,0|1,1,0]=3 99 B12R2.132 Nc1cnc2[nH]nc(c2c1)O 271570a_203496583355_100010174952 [0,1,0,0,0,0|2,0,0]=3 100 B12R2.132 Nc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100011934329 [0,1,0,0,0,0|2,0,0]=3 101 B12R2.132 Nc1n[nH]c2c1cc(cn2)O 271570a_203496583355_100000724694 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.132 Nc1noc2c1cc(cc2)O 271570a_203496583355_100012356444 [0,1,0,0,0,0|1,0,0]=2 103 B12R2.132 Nc1nsc2c1cc(cc2)O 271570a_203496583355_100010244976 [0,1,0,0,0,0|1,1,0]=3 104 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,0,0,0|2,0,1]=4 105 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,0,0,0|1,0,1]=3 106 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,1,0,0,0,0|1,0,2]=4 107 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,0,0,0|2,0,1]=4 108 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,1,0,0,0,0|1,0,2]=4 109 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,0,0,0|0,0,2]=3 110 B12R2.132 Oc1c[nH]c2c1cc(cn2)F 271570a_203496583355_100010168383 [0,1,0,0,0,0|3,0,0]=4 111 B12R2.132 Oc1ccc2[nH]nc(c2c1)Br 271570a_203496583355_200012353728 [0,1,0,0,0,0|2,0,0]=3 112 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [0,1,0,0,0,0|2,0,1]=4 113 B12R2.132 Oc1cnc2n1cc(cc2)Br 271570a_203496583355_100012343615 [0,1,0,0,0,0|3,0,0]=4 114 B12R2.132 Oc1cnc2n1cc(cc2)Cl 271570a_203496583355_200012351726 [0,1,0,0,0,0|3,0,0]=4 115 B12R2.132 Oc1cnc2n1cc(cc2)F 271570a_203496583355_100012350704 [0,1,0,0,0,0|3,0,0]=4 116 B12R2.132 Oc1cnn2c1cc(cc2)Br 271570a_203496583355_100015721393 [0,1,0,0,0,0|3,0,0]=4 117 B12R2.132 Oc1n[nH]c2c1cc(cc2)Br 271570a_203496583355_100010186058 [0,1,0,0,0,0|1,0,0]=2 118 B12R2.132 Oc1n[nH]c2c1cc(cc2)Cl 271570a_203496583355_100010174404 [0,1,0,0,0,0|1,0,0]=2 119 B12R2.132 Oc1n[nH]c2c1cc(cc2)F 271570a_203496583355_100011934747 [0,1,0,0,0,0|1,0,0]=2 120 B12R2.132 Oc1n[nH]c2c1cc(cn2)Br 271570a_203496583355_100010212350 [0,1,0,0,0,0|2,0,0]=3 121 B12R2.132 Oc1n[nH]c2c1cc(cn2)Cl 271570a_203496583355_100010289580 [0,1,0,0,0,0|2,0,0]=3 122 B12R2.132 Oc1n[nH]c2c1cc(cn2)F 271570a_203496583355_100010289577 [0,1,0,0,0,0|2,0,0]=3 123 B12R2.132 Oc1n[nH]c2c1cc(nc2)Br 271570a_203496583355_100010296430 [0,1,0,0,0,0|2,0,0]=3 124 B12R2.132 Oc1n[nH]c2c1nc(cc2)Br 271570a_203496583355_200010370904 [0,1,0,0,0,0|2,0,0]=3 125 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,0,0,0|3,0,0]=4 126 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [0,1,0,0,0,0|1,0,0]=2 127 B12R2.196 Cc1cccn2c1ncc2O 271570a_203496583355_100012351083 [0,1,0,0,0,0|3,0,0]=4 128 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,1,0,0,0,0|2,0,0]=3 129 B12R2.196 Cc1nnc2n1cccc2O 271570a_203496583355_200010194233 [0,1,0,0,0,0|3,0,0]=4 130 B12R2.196 Cn1ncc2c1cccc2O 271570a_203496583355_100009817161 [0,1,0,0,0,0|3,0,0]=4 131 B12R2.196 NC1COc2c1cccc2O 271570a_203496583355_100025715106 [0,1,0,0,0,0|2,0,1]=4 132 B12R2.196 Nc1cccc2c1[nH]nc2O 271570a_203496583355_100009888981 [0,1,0,0,0,0|1,0,0]=2 133 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [0,1,0,0,0,0|2,0,0]=3 134 B12R2.196 Nc1noc2c1cccc2O 271570a_203496583355_100010069758 [0,1,0,0,0,0|1,0,0]=2 135 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,0,0,0|2,0,1]=4 136 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,0,0,0|1,0,1]=3 137 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,0,0,0|1,0,2]=4 138 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,0,0,0|2,0,1]=4 139 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,0,0,0|1,0,2]=4 140 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,1,0,0,0,0|2,0,1]=4 141 B12R2.196 Oc1cccn2c1ncc2O 271570a_203496583355_200020799507 [0,1,0,0,0,0|3,0,0]=4 142 B12R2.196 Oc1cnc2n1cccc2Br 271570a_203496583355_100013004016 [0,1,0,0,0,0|3,0,0]=4 143 B12R2.196 Oc1cnc2n1cccc2Cl 271570a_203496583355_100010025871 [0,1,0,0,0,0|3,0,0]=4 144 B12R2.196 Oc1cnc2n1cccc2F 271570a_203496583355_100009817165 [0,1,0,0,0,0|3,0,0]=4 145 B12R2.196 Oc1n[nH]c2c1cccc2Br 271570a_203496583355_100010197283 [0,1,0,0,0,0|1,0,0]=2 146 B12R2.196 Oc1n[nH]c2c1cccc2Cl 271570a_203496583355_100000050086 [0,1,0,0,0,0|1,0,0]=2 147 B12R2.196 Oc1n[nH]c2c1cccc2F 271570a_203496583355_100010231504 [0,1,0,0,0,0|1,0,0]=2 148 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [0,1,0,0,0,0|1,0,0]=2 149 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [0,1,0,0,0,0|3,0,0]=4 150 B12R2.203 Cc1cccc2c1c(n[nH]2)O 271570a_203496583355_100000049903 [0,1,0,0,0,0|1,0,0]=2 151 B12R2.203 Cc1cccc2n1c(cn2)O 271570a_203496583355_100012566946 [0,1,0,0,0,0|3,0,0]=4 152 B12R2.203 Cc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100010205804 [0,1,0,0,0,0|2,0,0]=3 153 B12R2.203 Cn1ncc2c1c(ccc2)O 271570a_203496583355_100009817178 [0,1,0,0,0,0|3,0,0]=4 154 B12R2.203 Nc1cccc2c1c(n[nH]2)O 271570a_203496583355_100010186038 [0,1,0,0,0,0|1,0,0]=2 155 B12R2.203 Nc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100000049960 [0,1,0,0,0,0|2,0,0]=3 156 B12R2.203 Nc1nccc2c1c(co2)O 271570a_203496583355_200010135222 [0,1,0,0,0,0|2,0,0]=3 157 B12R2.203 Nc1nccc2c1c(cs2)O 271570a_203496583355_200010188537 [0,1,0,0,0,0|2,1,0]=4 158 B12R2.203 Nc1ncnc2c1c(n[nH]2)O 271570a_203496583355_100000049786 [0,1,0,0,0,0|3,0,0]=4 159 B12R2.203 Nc1noc2c1c(ccc2)O 271570a_203496583355_100012361266 [0,1,0,0,0,0|1,0,0]=2 160 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [0,1,0,0,0,0|2,0,1]=4 161 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [0,1,0,0,0,0|1,0,1]=3 162 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [0,1,0,0,0,0|1,0,2]=4 163 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [0,1,0,0,0,0|2,0,1]=4 164 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [0,1,0,0,0,0|1,0,2]=4 165 B12R2.203 O=c1[nH]cnc2c1c(n[nH]2)O 271570a_203496583355_100000751889 [0,1,0,0,0,0|3,0,0]=4 166 B12R2.203 Oc1c[nH]c2c1c(ccn2)Br 271570a_203496583355_100010212587 [0,1,0,0,0,0|3,0,0]=4 167 B12R2.203 Oc1c[nH]c2c1c(ccn2)F 271570a_203496583355_100010168365 [0,1,0,0,0,0|3,0,0]=4 168 B12R2.203 Oc1c[nH]c2c1c(ncc2)O 271570a_203496583355_100010168626 [0,1,0,0,0,0|3,0,0]=4 169 B12R2.203 Oc1cccc2c1C(CS2)O 271570a_203496583355_200010991195 [0,1,0,0,0,0|1,1,1]=4 170 B12R2.203 Oc1csc2c1c(ncc2)O 271570a_203496583355_100010126227 [0,1,0,0,0,0|2,1,0]=4 171 B12R2.203 Oc1n[nH]c2c1c(ccc2)Br 271570a_203496583355_100010186043 [0,1,0,0,0,0|1,0,0]=2 172 B12R2.203 Oc1n[nH]c2c1c(ccc2)Cl 271570a_203496583355_100000049730 [0,1,0,0,0,0|1,0,0]=2 173 B12R2.203 Oc1n[nH]c2c1c(ccc2)F 271570a_203496583355_100000049989 [0,1,0,0,0,0|1,0,0]=2 174 B12R2.203 Oc1n[nH]c2c1c(ccn2)Cl 271570a_203496583355_100010090772 [0,1,0,0,0,0|2,0,0]=3 175 B12R2.203 Oc1n[nH]c2c1c(ncc2)Br 271570a_203496583355_100010370910 [0,1,0,0,0,0|2,0,0]=3 176 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,0,0,0|3,0,0]=4 177 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [0,1,0,0,0,0|1,0,0]=2 178 B12R2.612 Cc1ccn2c(cnc2c1)O 271570a_203496583355_100011934683 [0,1,0,0,0,0|3,0,0]=4 179 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,0,0,0|2,0,0]=3 180 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,1,0,0,0,0|2,0,0]=3 181 B12R2.612 Cc1n[nH]c2c1cnc(c2)O 271570a_203496583355_100000700029 [0,1,0,0,0,0|3,0,0]=4 182 B12R2.612 Cc1ncc2n1ccc(c2)O 271570a_203496583355_100000730832 [0,1,0,0,0,0|3,0,0]=4 183 B12R2.612 Cc1nnc2n1ccc(c2)O 271570a_203496583355_100010163533 [0,1,0,0,0,0|3,0,0]=4 184 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,1,0,0,0,0|1,0,0]=2 185 B12R2.612 Cn1ncc2c1ccc(c2)O 271570a_203496583355_100009817176 [0,1,0,0,0,0|3,0,0]=4 186 B12R2.612 Cn1nnc2c1ccc(c2)O 271570a_203496583355_100000724718 [0,1,0,0,0,0|3,0,0]=4 187 B12R2.612 NC1COc2c1ccc(c2)O 271570a_203496583355_100020628175 [0,1,0,0,0,0|2,0,1]=4 188 B12R2.612 Nc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100009816878 [0,1,0,0,0,0|1,0,0]=2 189 B12R2.612 Nc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100011934401 [0,1,0,0,0,0|2,0,0]=3 190 B12R2.612 Nc1n[nH]c2c1ncc(c2)O 271570a_203496583355_100010187618 [0,1,0,0,0,0|3,0,0]=4 191 B12R2.612 Nc1noc2c1ccc(c2)O 271570a_203496583355_100012356334 [0,1,0,0,0,0|1,0,0]=2 192 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,0,0,0|2,0,1]=4 193 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,0,0,0|2,0,1]=4 194 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,0,0,0|1,0,1]=3 195 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,0,0,0|1,0,2]=4 196 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,0,0,0|2,0,1]=4 197 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,0,0,0|1,0,2]=4 198 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,1,0,0,0,0|2,0,1]=4 199 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [0,1,0,0,0,0|0,0,0]=1 200 B12R2.612 Oc1cnc2n1ccc(c2)Br 271570a_203496583355_100010730183 [0,1,0,0,0,0|3,0,0]=4 201 B12R2.612 Oc1cnc2n1ccc(c2)F 271570a_203496583355_100020640160 [0,1,0,0,0,0|3,0,0]=4 202 B12R2.612 Oc1n[nH]c2c1ccc(c2)Br 271570a_203496583355_100010186045 [0,1,0,0,0,0|1,0,0]=2 203 B12R2.612 Oc1n[nH]c2c1ccc(c2)Cl 271570a_203496583355_100000049627 [0,1,0,0,0,0|1,0,0]=2 204 B12R2.612 Oc1n[nH]c2c1ccc(c2)F 271570a_203496583355_100000049990 [0,1,0,0,0,0|1,0,0]=2 205 B12R2.612 Oc1n[nH]c2c1ncc(c2)Br 271570a_203496583355_100010289622 [0,1,0,0,0,0|2,0,0]=3 206 B12R2.2028 Cc1nc(c2n1ccnc2)O 271570a_203496583355_100010220708 [0,1,0,0,0,0|3,0,0]=4 207 B12R2.2028 Cn1cc(c2c1nccc2)O 271570a_203496583355_100010205794 [0,1,0,0,0,0|3,0,0]=4 208 B12R2.2028 Cn1nc(c2c1cccc2)O 271570a_203496583355_100009817141 [0,1,0,0,0,0|1,0,0]=2 209 B12R2.2028 Cn1nc(c2c1cccn2)O 271570a_203496583355_100000761950 [0,1,0,0,0,0|2,0,0]=3 210 B12R2.2028 Cn1nc(c2c1nccc2)O 271570a_203496583355_100010248644 [0,1,0,0,0,0|2,0,0]=3 211 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [0,0,1,0,0,0|2,0,1]=4 212 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [0,0,1,0,0,0|1,0,2]=4 213 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [0,0,1,0,0,0|1,0,2]=4 214 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [0,0,1,0,0,0|1,0,2]=4 215 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [0,0,1,0,0,0|1,0,2]=4 216 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [0,0,1,0,0,0|2,0,1]=4 217 B10R1.17 C#CCOc1ccccc1 34a_100000210340_100000184674 [0,0,1,0,0,0|2,0,1]=4 218 B10R1.17 C#CCOc1ccccc1 7a_100000210340_100000038162 [0,0,1,0,0,0|2,0,1]=4 219 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [0,0,1,0,0,0|3,0,0]=4 220 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [0,0,1,0,0,0|2,0,0]=3 221 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [0,0,1,0,0,0|2,0,0]=3 222 B10R1.17 C=CCOc1cccnc1 34a_100000210849_100015514636 [0,0,1,0,0,0|3,0,0]=4 223 B10R1.17 C=CCOc1cccnc1 7a_100000210849_100015514636 [0,0,1,0,0,0|3,0,0]=4 224 B10R1.17 C=CCOc1ccncc1 34a_100000212176_100015514636 [0,0,1,0,0,0|3,0,0]=4 225 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [0,0,1,0,0,0|2,1,0]=4 226 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [0,0,1,0,0,0|2,1,0]=4 227 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [0,0,1,0,0,0|2,0,0]=3 228 B10R1.17 CC=NNc1ccccn1 4a_100000183288_200000210099 [0,0,1,0,0,0|3,0,0]=4 229 B10R1.17 CC=NNc1cccnc1 4a_100000728903_200000210099 [0,0,1,0,0,0|3,0,0]=4 230 B10R1.17 CC=NNc1ccncc1 4a_100000698918_200000210099 [0,0,1,0,0,0|3,0,0]=4 231 B10R1.17 CCCOc1ccccc1 34a_100000210340_100000210303 [0,0,1,0,0,0|2,0,1]=4 232 B10R1.17 CCCOc1ccccc1 7a_100000210340_100000210303 [0,0,1,0,0,0|2,0,1]=4 233 B10R1.17 CSCOc1ccccc1 34a_100000210340_100011218213 [0,0,1,0,0,0|3,0,0]=4 234 B10R1.17 FCCOc1ccccc1 34a_100000210340_100011217306 [0,0,1,0,0,0|2,0,1]=4 235 B10R1.17 FCCOc1ccccc1 7a_100000210340_100011217306 [0,0,1,0,0,0|2,0,1]=4 236 B10R1.17 N#CCOc1ccccc1 7a_100000210340_100011215382 [0,0,1,0,0,0|2,0,1]=4 237 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [0,0,1,0,0,0|2,0,1]=4 238 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [0,0,1,0,0,0|1,0,1]=3 239 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [0,0,1,0,0,0|1,0,1]=3 240 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [0,0,1,0,0,0|2,0,1]=4 241 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [0,0,1,0,0,0|2,0,1]=4 242 B10R1.17 O=CCOc1ccncc1 34a_100000212176_200009817547 [0,0,1,0,0,0|2,0,1]=4 243 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [0,0,1,0,0,0|1,1,1]=4 244 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [0,0,1,0,0,0|1,1,1]=4 245 B10R1.17 OCCNc1ccccc1 34a_100000106764_100000211926 [0,0,1,0,0,0|2,0,1]=4 246 B10R1.17 OCCOc1ccccc1 34a_100000210340_100000211926 [0,0,1,0,0,0|1,0,1]=3 247 B10R1.17 OCCOc1ccccc1 7a_100000210340_100000211926 [0,0,1,0,0,0|1,0,1]=3 248 B10R1.17 OCCOc1cccnc1 34a_100000210849_100000211926 [0,0,1,0,0,0|2,0,1]=4 249 B10R1.17 OCCOc1cccnc1 7a_100000210849_100000211926 [0,0,1,0,0,0|2,0,1]=4 250 B10R1.17 OCCOc1ccncc1 34a_100000212176_100000211926 [0,0,1,0,0,0|2,0,1]=4 251 B10R1.17 OCCSc1ccccc1 62a_100000211926_100000041952 [0,0,1,0,0,0|1,1,1]=4 252 B10R1.17 OCCSc1ccccc1 62a_100000719477_100000211926 [0,0,1,0,0,0|1,1,1]=4 253 B10R1.20 C#Cc1ccccc1OC 34a_200011470546_200000210301 [0,0,1,0,0,0|2,0,1]=4 254 B10R1.20 C#Cc1ccccc1OC 7a_200011470546_200000210301 [0,0,1,0,0,0|2,0,1]=4 255 B10R1.20 C#Cc1ccccc1O[13CH3] 34a_200011470546_200025704644 [0,0,1,0,0,0|2,0,1]=4 256 B10R1.20 C#Cc1ccccc1O[13CH3] 7a_200011470546_200025704644 [0,0,1,0,0,0|2,0,1]=4 257 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [0,0,1,0,0,0|2,0,1]=4 258 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [0,0,1,0,0,0|2,0,1]=4 259 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [0,0,1,0,0,0|3,0,0]=4 260 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [0,0,1,0,0,0|2,0,1]=4 261 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [0,0,1,0,0,0|2,0,1]=4 262 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [0,0,1,0,0,0|3,0,0]=4 263 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [0,0,1,0,0,0|3,0,0]=4 264 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [0,0,1,0,0,0|2,0,1]=4 265 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [0,0,1,0,0,0|3,0,0]=4 266 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [0,0,1,0,0,0|2,0,0]=3 267 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [0,0,1,0,0,0|2,1,0]=4 268 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [0,0,1,0,0,0|2,1,0]=4 269 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [0,0,1,0,0,0|2,1,0]=4 270 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [0,0,1,0,0,0|2,1,0]=4 271 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [0,0,1,0,0,0|2,1,0]=4 272 B10R1.20 C=Cc1cccnc1OC 271570a_100011290941_100000047025 [0,0,1,0,0,0|3,0,0]=4 273 B10R1.20 C=Cc1ccncc1OC 271570a_100011290941_100016988167 [0,0,1,0,0,0|3,0,0]=4 274 B10R1.20 C=Cc1cnccc1OC 271570a_100011290941_100011997281 [0,0,1,0,0,0|3,0,0]=4 275 B10R1.20 C=Cc1ncccc1OC 271570a_100011290941_100000690851 [0,0,1,0,0,0|3,0,0]=4 276 B10R1.20 CCc1ccccc1OC 34a_100000210936_200000210301 [0,0,1,0,0,0|2,0,1]=4 277 B10R1.20 CCc1ccccc1OC 7a_100000210936_200000210301 [0,0,1,0,0,0|2,0,1]=4 278 B10R1.20 CCc1ccccc1O[13CH3] 34a_100000210936_200025704644 [0,0,1,0,0,0|2,0,1]=4 279 B10R1.20 CCc1ccccc1O[13CH3] 7a_100000210936_200025704644 [0,0,1,0,0,0|2,0,1]=4 280 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [0,0,1,0,0,0|2,0,1]=4 281 B10R1.20 CNc1ccccc1OC 34a_100000033821_200000210301 [0,0,1,0,0,0|3,0,0]=4 282 B10R1.20 CNc1ccccc1OC 34a_100000210025_200000210301 [0,0,1,0,0,0|3,0,0]=4 283 B10R1.20 CNc1ccccc1O[13CH3] 34a_100000033821_200025704644 [0,0,1,0,0,0|3,0,0]=4 284 B10R1.20 COc1ccccc1C#N 34a_100000211048_200000210301 [0,0,1,0,0,0|2,0,1]=4 285 B10R1.20 COc1ccccc1C#N 7a_100000211048_200000210301 [0,0,1,0,0,0|2,0,1]=4 286 B10R1.20 COc1ccccc1CN 34a_100000185550_200000210301 [0,0,1,0,0,0|2,0,1]=4 287 B10R1.20 COc1ccccc1CO 34a_100011216872_200000210301 [0,0,1,0,0,0|1,0,1]=3 288 B10R1.20 COc1ccccc1N[13CH3] 34a_100000210025_200025704644 [0,0,1,0,0,0|3,0,0]=4 289 B10R1.20 COc1ccccc1OC 34a_100000210385_200000210301 [0,0,1,0,0,0|3,0,0]=4 290 B10R1.20 COc1ccccc1O[13CH3] 34a_100000210385_200025704644 [0,0,1,0,0,0|3,0,0]=4 291 B10R1.20 COc1ccccc1SC 34a_100011216402_200000210301 [0,0,1,0,0,0|3,0,0]=4 292 B10R1.20 COc1ccccc1SC 62a_100000210334_200000210301 [0,0,1,0,0,0|3,0,0]=4 293 B10R1.20 COc1ccccc1SC 62a_200000210301_100000210334 [0,0,1,0,0,0|3,0,0]=4 294 B10R1.20 COc1ccccc1S[13CH3] 62a_100000210334_200025704644 [0,0,1,0,0,0|3,0,0]=4 295 B10R1.20 COc1ccccc1S[13CH3] 62a_200025704644_100000210334 [0,0,1,0,0,0|3,0,0]=4 296 B10R1.20 COc1cccnc1CO 34a_100000731849_200000210301 [0,0,1,0,0,0|2,0,1]=4 297 B10R1.20 COc1cnccc1CO 34a_100000078615_200000210301 [0,0,1,0,0,0|2,0,1]=4 298 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [0,0,1,0,0,0|1,1,1]=4 299 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [0,0,1,0,0,0|1,1,1]=4 300 B10R1.20 CSc1ccccc1CO 62a_100000187465_200000210301 [0,0,1,0,0,0|1,1,1]=4 301 B10R1.20 CSc1ccccc1CO 62a_200000210301_100000187465 [0,0,1,0,0,0|1,1,1]=4 302 B10R1.20 CSc1ccccc1O[13CH3] 34a_100011216402_200025704644 [0,0,1,0,0,0|3,0,0]=4 303 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [0,0,1,0,0,0|2,0,1]=4 304 B10R1.20 [13CH3]Oc1ccccc1C#N 34a_100000211048_200025704644 [0,0,1,0,0,0|2,0,1]=4 305 B10R1.20 [13CH3]Oc1ccccc1C#N 7a_100000211048_200025704644 [0,0,1,0,0,0|2,0,1]=4 306 B10R1.20 [13CH3]Oc1ccccc1CN 34a_100000185550_200025704644 [0,0,1,0,0,0|2,0,1]=4 307 B10R1.20 [13CH3]Oc1ccccc1CO 34a_100011216872_200025704644 [0,0,1,0,0,0|1,0,1]=3 308 B10R1.20 [13CH3]Oc1cccnc1CO 34a_100000731849_200025704644 [0,0,1,0,0,0|2,0,1]=4 309 B10R1.20 [13CH3]Oc1cnccc1CO 34a_100000078615_200025704644 [0,0,1,0,0,0|2,0,1]=4 310 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [0,0,1,0,0,0|1,1,1]=4 311 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [0,0,1,0,0,0|1,1,1]=4 312 B10R1.20 [13CH3]Sc1ccccc1CO 62a_100000187465_200025704644 [0,0,1,0,0,0|1,1,1]=4 313 B10R1.20 [13CH3]Sc1ccccc1CO 62a_200025704644_100000187465 [0,0,1,0,0,0|1,1,1]=4 314 B10R1.29 C=CCSc1conc1N 62a_100000210623_100012597345 [0,0,1,0,0,0|2,0,1]=4 315 B10R1.29 C=CCSc1conc1N 62a_100012597345_100000210623 [0,0,1,0,0,0|2,0,1]=4 316 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [0,0,1,0,0,0|3,0,0]=4 317 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,0,1,0,0,0|3,0,0]=4 318 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [0,0,1,0,0,0|3,0,0]=4 319 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [0,0,1,0,0,0|3,0,0]=4 320 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [0,0,1,0,0,0|3,0,0]=4 321 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [0,0,1,0,0,0|2,0,0]=3 322 B10R1.61 C=C(C)c1ccncc1O 271570a_100000694244_100009817591 [0,0,1,0,0,0|3,0,0]=4 323 B10R1.61 C=C(C)c1ncccc1O 271570a_100000694244_100000034122 [0,0,1,0,0,0|3,0,0]=4 324 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [0,0,1,0,0,0|2,0,1]=4 325 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [0,0,1,0,0,0|2,0,1]=4 326 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [0,0,1,0,0,0|2,0,1]=4 327 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [0,0,1,0,0,0|2,0,1]=4 328 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [0,0,1,0,0,0|2,0,1]=4 329 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [0,0,1,0,0,0|1,0,1]=3 330 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [0,0,1,0,0,0|1,0,1]=3 331 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [0,0,1,0,0,0|1,0,2]=4 332 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [0,0,1,0,0,0|2,0,1]=4 333 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [0,0,1,0,0,0|2,0,1]=4 334 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [0,0,1,0,0,0|2,0,1]=4 335 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [0,0,1,0,0,0|2,0,1]=4 336 B10R1.61 CC(C)c1ccccc1O 271570a_203496583355_100011218076 [0,0,1,0,0,0|2,0,1]=4 337 B10R1.61 CC(N)c1ccccc1O 271570a_203496583355_100000181357 [0,0,1,0,0,0|1,0,2]=4 338 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [0,0,1,0,0,0|1,0,1]=3 339 B10R1.61 CC(O)c1cccnc1O 271570a_203496583355_100009865335 [0,0,1,0,0,0|2,0,1]=4 340 B10R1.61 CN(C)c1ccccc1O 269982a_100000033821_200000210301 [0,0,1,0,0,0|3,0,0]=4 341 B10R1.61 CN(C)c1ccccc1O 271570a_203496583355_100011290883 [0,0,1,0,0,0|3,0,0]=4 342 B10R1.61 CN([13CH3])c1ccccc1O 269982a_100000033821_200025704644 [0,0,1,0,0,0|3,0,0]=4 343 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [0,0,1,0,0,0|2,0,1]=4 344 B10R1.61 C[C@H](O)c1ncccc1O 271570a_203496583355_100013325542 [0,0,1,0,0,0|2,0,1]=4 345 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [0,0,1,0,0,0|2,0,1]=4 346 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [0,0,1,0,0,0|0,0,2]=3 347 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [0,0,1,0,0,0|1,0,2]=4 348 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [0,0,1,0,0,0|1,0,2]=4 349 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [0,0,1,0,0,0|1,0,2]=4 350 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [0,0,1,0,0,0|1,0,2]=4 351 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [0,0,1,0,0,0|2,0,0]=3 352 B10R1.61 OB(O)c1cccnc1O 271570a_203496583355_100009815992 [0,0,1,0,0,0|3,0,0]=4 353 B10R1.61 OB(O)c1ccncc1O 271570a_203496583355_200010176179 [0,0,1,0,0,0|3,0,0]=4 354 B10R1.61 Oc1ccccc1C(F)F 271570a_203496583355_100010169824 [0,0,1,0,0,0|2,0,1]=4 355 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [0,0,1,0,0,0|2,0,1]=4 356 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [0,0,1,0,0,0|2,0,1]=4 357 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [0,0,1,0,0,0|2,0,1]=4 358 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [0,0,1,0,0,0|2,0,1]=4 359 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [0,0,1,0,0,0|1,0,1]=3 360 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [0,0,1,0,0,0|1,0,2]=4 361 B10R1.187 C=C=Cc1c(noc1C)C 271570a_100015277604_100000694658 [0,0,1,0,0,0|1,0,2]=4 362 B10R1.187 C=C=Cc1c(noc1C)N 271570a_100015277604_100011216220 [0,0,1,0,0,0|1,0,2]=4 363 B10R1.187 C=C=Cc1c(noc1C)O 271570a_100015277604_100010730664 [0,0,1,0,0,0|0,0,2]=3 364 B10R1.187 C=C=Cc1c(noc1N)C 271570a_100015277604_100000754107 [0,0,1,0,0,0|2,0,1]=4 365 B10R1.187 CC=Cc1c(noc1C)C 271570a_100016259895_100000694658 [0,0,1,0,0,0|1,0,2]=4 366 B10R1.187 CC=Cc1c(noc1C)N 271570a_100016259895_100011216220 [0,0,1,0,0,0|1,0,2]=4 367 B10R1.187 CC=Cc1c(noc1C)O 271570a_100016259895_100010730664 [0,0,1,0,0,0|0,0,2]=3 368 B10R1.187 CC=Cc1c(noc1N)C 271570a_100016259895_100000754107 [0,0,1,0,0,0|2,0,1]=4 369 B10R2.32 Oc1csc2c1scc2 271570a_203496583355_100009817191 [0,0,0,0,1,0|2,1,0]=4 370 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,1|1,0,0]=2 371 B12R2.24 Oc1cc2nccnc2cn1 271570a_203496583355_100010370699 [0,0,0,0,0,1|3,0,0]=4 372 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,1|2,0,0]=3 373 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,1|2,0,0]=3 374 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [0,0,0,0,0,1|3,0,0]=4 375 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [0,0,0,0,0,1|3,0,0]=4 376 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [0,0,0,0,0,1|3,0,0]=4 377 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [0,0,0,0,0,1|3,0,0]=4 378 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [0,0,0,0,0,1|3,0,0]=4 379 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [0,0,0,0,0,1|3,0,0]=4 380 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [0,0,0,0,0,1|3,0,0]=4 381 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,1|2,0,0]=3 382 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,1|2,0,0]=3 383 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [0,0,0,0,0,1|3,0,0]=4 384 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [0,0,0,0,0,1|3,0,0]=4 385 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,1|1,0,0]=2 386 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,0,0,0,0,1|2,0,0]=3 387 B12R2.1081 Oc1cccc2c1cccn2 271570a_203496583355_100011290932 [0,0,0,0,0,1|3,0,0]=4 388 B12R2.1081 Oc1cccc2c1ccnc2 271570a_203496583355_100000186358 [0,0,0,0,0,1|3,0,0]=4 389 B12R2.1081 Oc1cccc2c1cncc2 271570a_203496583355_100000685578 [0,0,0,0,0,1|3,0,0]=4 390 B12R2.1081 Oc1cccc2c1nccc2 271570a_203496583355_100011215545 [0,0,0,0,0,1|3,0,0]=4 391 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [0,0,0,0,0,1|2,0,0]=3 392 B12R2.1081 Oc1ccnc2c1cccn2 271570a_203496583355_100000087570 [0,0,0,0,0,1|3,0,0]=4 393 B12R2.1081 Oc1ccnc2c1cncc2 271570a_203496583355_100000095135 [0,0,0,0,0,1|3,0,0]=4 394 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [0,0,0,0,0,1|1,0,0]=2 395 B12R2.1081 Oc1cncc2c1cccn2 271570a_203496583355_100010211308 [0,0,0,0,0,1|2,0,0]=3 396 B12R2.1081 Oc1cncc2c1ccnc2 271570a_203496583355_100010134378 [0,0,0,0,0,1|2,0,0]=3 397 B12R2.1081 Oc1cncc2c1nccn2 271570a_203496583355_200010209543 [0,0,0,0,0,1|3,0,0]=4 398 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [0,0,0,0,0,1|1,0,0]=2 399 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [0,0,0,0,0,1|1,0,0]=2 400 B12R2.1081 Oc1nccc2c1cccn2 271570a_203496583355_100000077681 [0,0,0,0,0,1|2,0,0]=3 401 B12R2.1081 Oc1nccc2c1cncc2 271570a_203496583355_100000116921 [0,0,0,0,0,1|2,0,0]=3 402 B12R2.1081 Oc1nccc2c1nccc2 271570a_203496583355_100010063729 [0,0,0,0,0,1|2,0,0]=3 403 B12R2.1081 Oc1nccc2c1nccn2 271570a_203496583355_100010063732 [0,0,0,0,0,1|3,0,0]=4 404 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [0,0,0,0,0,1|1,0,0]=2 405 B12R2.1081 Oc1ncnc2c1cccn2 271570a_203496583355_100000026734 [0,0,0,0,0,1|2,0,0]=3 406 B12R2.1081 Oc1ncnc2c1ccnc2 271570a_203496583355_100000098430 [0,0,0,0,0,1|2,0,0]=3 407 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,1,0,0,0|2,0,0]=4 408 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,1,0,0,0|1,0,1]=4 409 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,1,0,0,0|1,0,1]=4 410 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,1,0,0,0|2,0,0]=4 411 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,1,0,0,0|2,0,0]=4 412 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,1,0,0,0|1,0,1]=4 413 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,1,0,0,0|1,0,1]=4 414 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 415 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 416 B9R1.12 C=CCSc1cnoc1 62a_100000210623_100009815712 [1,0,1,0,0,0|1,0,1]=4 417 B9R1.12 C=CCSc1cnoc1 62a_100009815712_100000210623 [1,0,1,0,0,0|1,0,1]=4 418 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,1,0,0,0|2,0,0]=4 419 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,1,0,0,0|2,0,0]=4 420 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,1,0,0,0|2,0,0]=4 421 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,1,0,0,0|2,0,0]=4 422 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,1,0,0,0|1,0,1]=4 423 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,1,0,0,0|1,0,0]=3 424 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,1,0,0,0|2,0,0]=4 425 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,1,0,0,0|2,0,0]=4 426 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,1,0,0,0|1,0,1]=4 427 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,1,0,0,0|2,0,0]=4 428 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,1,0,0,0|2,0,0]=4 429 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [1,0,1,0,0,0|2,0,0]=4 430 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [1,0,1,0,0,0|2,0,0]=4 431 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,1,0,0,0|1,0,1]=4 432 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,1,0,0,0|1,0,1]=4 433 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [1,0,1,0,0,0|2,0,0]=4 434 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [1,0,1,0,0,0|2,0,0]=4 435 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [1,0,1,0,0,0|2,0,0]=4 436 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [1,0,1,0,0,0|2,0,0]=4 437 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [1,0,1,0,0,0|2,0,0]=4 438 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [1,0,1,0,0,0|2,0,0]=4 439 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,1,0,0,0|2,0,0]=4 440 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,1,0,0,0|2,0,0]=4 441 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,1,0,0,0|1,0,0]=3 442 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,0,1,0,0,0|2,0,0]=4 443 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [1,0,1,0,0,0|2,0,0]=4 444 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,0,1,0,0,0|2,0,0]=4 445 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,0,1,0,0,0|2,0,0]=4 446 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,1,0,0,0|1,1,0]=4 447 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,1,0,0,0|1,1,0]=4 448 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,1,0,0,0|1,1,0]=4 449 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,1,0,0,0|1,0,1]=4 450 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,1,0,0,0|1,0,1]=4 451 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,1,0,0,0|0,0,2]=4 452 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,1,0,0,0|0,0,2]=4 453 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,1,0,0,0|1,0,1]=4 454 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,1,0,0,0|0,0,1]=3 455 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,1,0,0,0|1,0,1]=4 456 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,1,0,0,0|1,0,1]=4 457 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,1,0,0,0|1,0,1]=4 458 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,1,0,0,0|1,0,1]=4 459 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,1,0,0,0|0,0,1]=3 460 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,1,0,0,0|1,0,1]=4 461 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [1,0,1,0,0,0|1,0,1]=4 462 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,1,0,0,0|1,0,1]=4 463 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,0,1,0,0,0|1,0,1]=4 464 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,1,0,0,0|2,0,0]=4 465 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [1,0,1,0,0,0|2,0,0]=4 466 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [1,0,1,0,0,0|2,0,0]=4 467 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [1,0,1,0,0,0|2,0,0]=4 468 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [1,0,1,0,0,0|2,0,0]=4 469 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [1,0,1,0,0,0|2,0,0]=4 470 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [1,0,1,0,0,0|2,0,0]=4 471 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [1,0,1,0,0,0|2,0,0]=4 472 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [1,0,1,0,0,0|2,0,0]=4 473 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,1,0,0,0|2,0,0]=4 474 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,1,0,0,0|2,0,0]=4 475 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,1,0,0,0|1,1,0]=4 476 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,1,0,0,0|1,1,0]=4 477 B9R1.33 C=C=Cc1cnoc1C 271570a_100015277604_100009872056 [1,0,1,0,0,0|0,0,2]=4 478 B9R1.33 C=C=Cc1conc1N 271570a_100015277604_100012597345 [1,0,1,0,0,0|1,0,1]=4 479 B9R1.33 CC=Cc1cnoc1C 271570a_100016259895_100009872056 [1,0,1,0,0,0|0,0,2]=4 480 B9R1.33 CC=Cc1conc1N 271570a_100016259895_100012597345 [1,0,1,0,0,0|1,0,1]=4 481 B9R1.27 C=Cc1c(noc1C)C 271570a_100011290941_100000694658 [1,0,1,0,0,0|1,0,1]=4 482 B9R1.27 C=Cc1c(noc1C)N 271570a_100011290941_100011216220 [1,0,1,0,0,0|1,0,1]=4 483 B9R1.27 C=Cc1c(noc1C)O 271570a_100011290941_100010730664 [1,0,1,0,0,0|0,0,1]=3 484 B9R1.27 C=Cc1c(noc1N)C 271570a_100011290941_100000754107 [1,0,1,0,0,0|2,0,0]=4 485 B9R1.14 C=Cc1ccoc1C=O 271570a_100011290941_100000756499 [1,0,1,0,0,0|2,0,0]=4 486 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [0,1,1,0,0,0|1,0,1]=4 487 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [0,1,1,0,0,0|1,0,1]=4 488 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [0,1,1,0,0,0|1,0,1]=4 489 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,1,0,0,0|1,0,1]=4 490 B11R1.22 OCC(O)c1ccc(cc1)O 271570a_203496583355_200012355997 [0,1,1,0,0,0|1,0,1]=4 491 B11R1.39 C=CC(=O)Cc1cc(no1)Br 1458a_100000185746_100000709089 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.39 C=CC(=O)Cc1cc(no1)C 1458a_100000185746_100000707947 [0,1,1,0,0,0|1,0,1]=4 493 B11R1.1 C=CCOc1ccc(cc1)Br 34a_100000185759_100015514636 [0,1,1,0,0,0|2,0,0]=4 494 B11R1.1 C=CCOc1ccc(cc1)Br 7a_100000185759_100015514636 [0,1,1,0,0,0|2,0,0]=4 495 B11R1.1 C=CCOc1ccc(cc1)C 34a_100000210336_100015514636 [0,1,1,0,0,0|2,0,0]=4 496 B11R1.1 C=CCOc1ccc(cc1)C 7a_100000210336_100015514636 [0,1,1,0,0,0|2,0,0]=4 497 B11R1.1 C=CCOc1ccc(cc1)Cl 34a_100000210216_100015514636 [0,1,1,0,0,0|2,0,0]=4 498 B11R1.1 C=CCOc1ccc(cc1)Cl 7a_100000210216_100015514636 [0,1,1,0,0,0|2,0,0]=4 499 B11R1.1 C=CCOc1ccc(cc1)F 34a_100000210339_100015514636 [0,1,1,0,0,0|2,0,0]=4 500 B11R1.1 C=CCOc1ccc(cc1)I 34a_100000212066_100015514636 [0,1,1,0,0,0|2,0,0]=4 501 B11R1.1 C=CCOc1ccc(cc1)I 7a_100000212066_100015514636 [0,1,1,0,0,0|2,0,0]=4 502 B11R1.1 C=CCOc1ccc(cc1)N 34a_100000185829_100015514636 [0,1,1,0,0,0|2,0,0]=4 503 B11R1.1 C=CCOc1ccc(cc1)O 271570a_203496583355_100000172055 [0,1,1,0,0,0|2,0,0]=4 504 B11R1.1 CC=NNc1ccc(cc1)Br 4a_100000735608_200000210099 [0,1,1,0,0,0|2,0,0]=4 505 B11R1.1 CC=NNc1ccc(cc1)C 4a_100000683527_200000210099 [0,1,1,0,0,0|2,0,0]=4 506 B11R1.1 CC=NNc1ccc(cc1)Cl 4a_100000683521_200000210099 [0,1,1,0,0,0|2,0,0]=4 507 B11R1.1 CC=NNc1ccc(cc1)F 4a_100000728448_200000210099 [0,1,1,0,0,0|2,0,0]=4 508 B11R1.1 CC=NNc1ccc(cc1)I 4a_100016988836_200000210099 [0,1,1,0,0,0|2,0,0]=4 509 B11R1.1 Cc1ccc(cc1)OCC=O 34a_100000210336_200009817547 [0,1,1,0,0,0|1,0,1]=4 510 B11R1.1 Cc1ccc(cc1)OCC=O 7a_100000210336_200015260668 [0,1,1,0,0,0|1,0,1]=4 511 B11R1.1 Cc1ccc(cc1)OCCO 34a_100000210336_100000211926 [0,1,1,0,0,0|1,0,1]=4 512 B11R1.1 Cc1ccc(cc1)OCCO 7a_100000210336_100000211926 [0,1,1,0,0,0|1,0,1]=4 513 B11R1.1 Nc1ccc(cc1)OCC=O 34a_100000185829_200009817547 [0,1,1,0,0,0|1,0,1]=4 514 B11R1.1 Nc1ccc(cc1)OCCO 34a_100000185829_100000211926 [0,1,1,0,0,0|1,0,1]=4 515 B11R1.1 O=CCOc1ccc(cc1)Br 34a_100000185759_200009817547 [0,1,1,0,0,0|1,0,1]=4 516 B11R1.1 O=CCOc1ccc(cc1)Br 7a_100000185759_200015260668 [0,1,1,0,0,0|1,0,1]=4 517 B11R1.1 O=CCOc1ccc(cc1)Cl 34a_100000210216_200009817547 [0,1,1,0,0,0|1,0,1]=4 518 B11R1.1 O=CCOc1ccc(cc1)Cl 7a_100000210216_200015260668 [0,1,1,0,0,0|1,0,1]=4 519 B11R1.1 O=CCOc1ccc(cc1)F 34a_100000210339_200009817547 [0,1,1,0,0,0|1,0,1]=4 520 B11R1.1 O=CCOc1ccc(cc1)I 34a_100000212066_200009817547 [0,1,1,0,0,0|1,0,1]=4 521 B11R1.1 O=CCOc1ccc(cc1)I 7a_100000212066_200015260668 [0,1,1,0,0,0|1,0,1]=4 522 B11R1.1 OCCOc1ccc(cc1)Br 34a_100000185759_100000211926 [0,1,1,0,0,0|1,0,1]=4 523 B11R1.1 OCCOc1ccc(cc1)Br 7a_100000185759_100000211926 [0,1,1,0,0,0|1,0,1]=4 524 B11R1.1 OCCOc1ccc(cc1)Cl 34a_100000210216_100000211926 [0,1,1,0,0,0|1,0,1]=4 525 B11R1.1 OCCOc1ccc(cc1)Cl 7a_100000210216_100000211926 [0,1,1,0,0,0|1,0,1]=4 526 B11R1.1 OCCOc1ccc(cc1)F 34a_100000210339_100000211926 [0,1,1,0,0,0|1,0,1]=4 527 B11R1.1 OCCOc1ccc(cc1)I 34a_100000212066_100000211926 [0,1,1,0,0,0|1,0,1]=4 528 B11R1.1 OCCOc1ccc(cc1)I 7a_100000212066_100000211926 [0,1,1,0,0,0|1,0,1]=4 529 B11R1.1 OCCOc1ccc(cc1)O 271570a_203496583355_100000686261 [0,1,1,0,0,0|1,0,1]=4 530 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [0,1,1,0,0,0|2,0,0]=4 531 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [0,1,1,0,0,0|2,0,0]=4 532 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,1,1,0,0,0|2,0,0]=4 533 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,1,1,0,0,0|2,0,0]=4 534 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [0,1,1,0,0,0|2,0,0]=4 535 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [0,1,1,0,0,0|2,0,0]=4 536 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [0,1,1,0,0,0|2,0,0]=4 537 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [0,1,1,0,0,0|2,0,0]=4 538 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [0,1,1,0,0,0|2,0,0]=4 539 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [0,1,1,0,0,0|2,0,0]=4 540 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,1,1,0,0,0|2,0,0]=4 541 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,1,1,0,0,0|2,0,0]=4 542 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [0,1,1,0,0,0|2,0,0]=4 543 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,1,1,0,0,0|2,0,0]=4 544 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [0,1,1,0,0,0|2,0,0]=4 545 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [0,1,1,0,0,0|2,0,0]=4 546 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [0,1,1,0,0,0|2,0,0]=4 547 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,1,1,0,0,0|1,0,1]=4 548 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,1,1,0,0,0|1,0,1]=4 549 B11R1.17 Cc1ccccc1OCCO 34a_100000210338_100000211926 [0,1,1,0,0,0|1,0,1]=4 550 B11R1.17 Cc1ccccc1OCCO 7a_100000210338_100000211926 [0,1,1,0,0,0|1,0,1]=4 551 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,1,0,0,0|1,0,1]=4 552 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,1,0,0,0|1,0,1]=4 553 B11R1.17 Nc1ccccc1OCCO 34a_100000185747_100000211926 [0,1,1,0,0,0|1,0,1]=4 554 B11R1.17 Nc1ccccc1OCCO 7a_100000185747_100000211926 [0,1,1,0,0,0|1,0,1]=4 555 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,1,1,0,0,0|1,0,1]=4 556 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,1,1,0,0,0|1,0,1]=4 557 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,1,1,0,0,0|1,0,1]=4 558 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,1,1,0,0,0|1,0,1]=4 559 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,1,1,0,0,0|1,0,1]=4 560 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,1,1,0,0,0|1,0,1]=4 561 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,1,1,0,0,0|1,0,1]=4 562 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,1,1,0,0,0|1,0,1]=4 563 B11R1.17 OCCOc1ccccc1Br 34a_100000181306_100000211926 [0,1,1,0,0,0|1,0,1]=4 564 B11R1.17 OCCOc1ccccc1Br 7a_100000181306_100000211926 [0,1,1,0,0,0|1,0,1]=4 565 B11R1.17 OCCOc1ccccc1Cl 34a_100000210172_100000211926 [0,1,1,0,0,0|1,0,1]=4 566 B11R1.17 OCCOc1ccccc1Cl 7a_100000210172_100000211926 [0,1,1,0,0,0|1,0,1]=4 567 B11R1.17 OCCOc1ccccc1F 34a_100000210171_100000211926 [0,1,1,0,0,0|1,0,1]=4 568 B11R1.17 OCCOc1ccccc1F 7a_100000210171_100000211926 [0,1,1,0,0,0|1,0,1]=4 569 B11R1.17 OCCOc1ccccc1I 34a_100000739446_100000211926 [0,1,1,0,0,0|1,0,1]=4 570 B11R1.17 OCCOc1ccccc1I 7a_100000739446_100000211926 [0,1,1,0,0,0|1,0,1]=4 571 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [0,1,1,0,0,0|1,0,1]=4 572 B11R1.24 C=CCOc1cccc(c1)Br 34a_100000210342_100015514636 [0,1,1,0,0,0|2,0,0]=4 573 B11R1.24 C=CCOc1cccc(c1)Br 7a_100000210342_100015514636 [0,1,1,0,0,0|2,0,0]=4 574 B11R1.24 C=CCOc1cccc(c1)C 34a_100000210337_100015514636 [0,1,1,0,0,0|2,0,0]=4 575 B11R1.24 C=CCOc1cccc(c1)C 7a_100000210337_100015514636 [0,1,1,0,0,0|2,0,0]=4 576 B11R1.24 C=CCOc1cccc(c1)Cl 34a_100000210295_100015514636 [0,1,1,0,0,0|2,0,0]=4 577 B11R1.24 C=CCOc1cccc(c1)Cl 7a_100000210295_100015514636 [0,1,1,0,0,0|2,0,0]=4 578 B11R1.24 C=CCOc1cccc(c1)F 34a_100000210426_100015514636 [0,1,1,0,0,0|2,0,0]=4 579 B11R1.24 C=CCOc1cccc(c1)F 7a_100000210426_100015514636 [0,1,1,0,0,0|2,0,0]=4 580 B11R1.24 C=CCOc1cccc(c1)I 34a_100000211634_100015514636 [0,1,1,0,0,0|2,0,0]=4 581 B11R1.24 C=CCOc1cccc(c1)I 7a_100000211634_100015514636 [0,1,1,0,0,0|2,0,0]=4 582 B11R1.24 C=CCOc1cccc(c1)N 34a_100000210217_100015514636 [0,1,1,0,0,0|2,0,0]=4 583 B11R1.24 CC=NNc1cccc(c1)Br 4a_100000217339_200000210099 [0,1,1,0,0,0|2,0,0]=4 584 B11R1.24 CC=NNc1cccc(c1)C 4a_100000681630_200000210099 [0,1,1,0,0,0|2,0,0]=4 585 B11R1.24 CC=NNc1cccc(c1)Cl 4a_100000184277_200000210099 [0,1,1,0,0,0|2,0,0]=4 586 B11R1.24 CC=NNc1cccc(c1)F 4a_100000745080_200000210099 [0,1,1,0,0,0|2,0,0]=4 587 B11R1.24 CC=NNc1cccc(c1)I 4a_100020605690_200000210099 [0,1,1,0,0,0|2,0,0]=4 588 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [0,1,1,0,0,0|1,0,1]=4 589 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [0,1,1,0,0,0|1,0,1]=4 590 B11R1.24 Cc1cccc(c1)OCCO 34a_100000210337_100000211926 [0,1,1,0,0,0|1,0,1]=4 591 B11R1.24 Cc1cccc(c1)OCCO 7a_100000210337_100000211926 [0,1,1,0,0,0|1,0,1]=4 592 B11R1.24 Nc1cccc(c1)OCC=O 34a_100000210217_200009817547 [0,1,1,0,0,0|1,0,1]=4 593 B11R1.24 Nc1cccc(c1)OCCO 34a_100000210217_100000211926 [0,1,1,0,0,0|1,0,1]=4 594 B11R1.24 O=CCOc1cccc(c1)Br 34a_100000210342_200009817547 [0,1,1,0,0,0|1,0,1]=4 595 B11R1.24 O=CCOc1cccc(c1)Br 7a_100000210342_200015260668 [0,1,1,0,0,0|1,0,1]=4 596 B11R1.24 O=CCOc1cccc(c1)Cl 34a_100000210295_200009817547 [0,1,1,0,0,0|1,0,1]=4 597 B11R1.24 O=CCOc1cccc(c1)Cl 7a_100000210295_200015260668 [0,1,1,0,0,0|1,0,1]=4 598 B11R1.24 O=CCOc1cccc(c1)F 34a_100000210426_200009817547 [0,1,1,0,0,0|1,0,1]=4 599 B11R1.24 O=CCOc1cccc(c1)F 7a_100000210426_200015260668 [0,1,1,0,0,0|1,0,1]=4 600 B11R1.24 O=CCOc1cccc(c1)I 34a_100000211634_200009817547 [0,1,1,0,0,0|1,0,1]=4 601 B11R1.24 O=CCOc1cccc(c1)I 7a_100000211634_200015260668 [0,1,1,0,0,0|1,0,1]=4 602 B11R1.24 OCCOc1cccc(c1)Br 34a_100000210342_100000211926 [0,1,1,0,0,0|1,0,1]=4 603 B11R1.24 OCCOc1cccc(c1)Br 7a_100000210342_100000211926 [0,1,1,0,0,0|1,0,1]=4 604 B11R1.24 OCCOc1cccc(c1)Cl 34a_100000210295_100000211926 [0,1,1,0,0,0|1,0,1]=4 605 B11R1.24 OCCOc1cccc(c1)Cl 7a_100000210295_100000211926 [0,1,1,0,0,0|1,0,1]=4 606 B11R1.24 OCCOc1cccc(c1)F 34a_100000210426_100000211926 [0,1,1,0,0,0|1,0,1]=4 607 B11R1.24 OCCOc1cccc(c1)F 7a_100000210426_100000211926 [0,1,1,0,0,0|1,0,1]=4 608 B11R1.24 OCCOc1cccc(c1)I 34a_100000211634_100000211926 [0,1,1,0,0,0|1,0,1]=4 609 B11R1.24 OCCOc1cccc(c1)I 7a_100000211634_100000211926 [0,1,1,0,0,0|1,0,1]=4 610 B11R1.24 OCCOc1cccc(c1)O 271570a_203496583355_100000757546 [0,1,1,0,0,0|1,0,1]=4 611 B11R1.28 C/C=C/COc1ccccc1 34a_100000210340_100102629194 [0,1,1,0,0,0|2,0,0]=4 612 B11R1.28 C/C=C/COc1ccccc1 7a_100000210340_100102629194 [0,1,1,0,0,0|2,0,0]=4 613 B11R1.28 C=CCCOc1ccccc1 34a_100000210340_100000754431 [0,1,1,0,0,0|2,0,0]=4 614 B11R1.28 C=CCCOc1ccccc1 7a_100000210340_100000754431 [0,1,1,0,0,0|2,0,0]=4 615 B11R1.28 C=CCOCc1ccccc1 34a_100000210790_100015514636 [0,1,1,0,0,0|2,0,0]=4 616 B11R1.28 C=CCOCc1ccccc1 34a_200000210373_100015291786 [0,1,1,0,0,0|2,0,0]=4 617 B11R1.28 C=CCOCc1ccccc1 7a_100000210790_100015514636 [0,1,1,0,0,0|2,0,0]=4 618 B11R1.28 CC=CCOc1ccccc1 34a_100000210340_100000070051 [0,1,1,0,0,0|2,0,0]=4 619 B11R1.28 CC=CCOc1ccccc1 7a_100000210340_100000070051 [0,1,1,0,0,0|2,0,0]=4 620 B11R1.28 CC=NNCc1ccccc1 4a_100000007032_200000210099 [0,1,1,0,0,0|2,0,0]=4 621 B11R1.28 CCC=NNc1ccccc1 4a_100015195140_100000210100 [0,1,1,0,0,0|2,0,0]=4 622 B11R1.28 COCCOc1ccccc1 34a_100000210260_200000210301 [0,1,1,0,0,0|1,0,1]=4 623 B11R1.28 COCCOc1ccccc1 34a_100000210340_100011201679 [0,1,1,0,0,0|1,0,1]=4 624 B11R1.28 COCCOc1ccccc1 34a_100138415774_100000184471 [0,1,1,0,0,0|1,0,1]=4 625 B11R1.28 COCCOc1ccccc1 7a_100000210260_200000210301 [0,1,1,0,0,0|1,0,1]=4 626 B11R1.28 COCCOc1ccccc1 7a_100000210340_100000233755 [0,1,1,0,0,0|1,0,1]=4 627 B11R1.28 O=CCOCc1ccccc1 34a_100000210790_200009817547 [0,1,1,0,0,0|1,0,1]=4 628 B11R1.28 O=CCOCc1ccccc1 7a_100000210790_200015260668 [0,1,1,0,0,0|1,0,1]=4 629 B11R1.28 OCCCOc1ccccc1 34a_100000210340_100000230001 [0,1,1,0,0,0|1,0,1]=4 630 B11R1.28 OCCCOc1ccccc1 7a_100000210340_100011215043 [0,1,1,0,0,0|1,0,1]=4 631 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [0,1,1,0,0,0|1,0,1]=4 632 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [0,1,1,0,0,0|1,0,1]=4 633 B11R1.28 [13CH3]OCCOc1ccccc1 34a_100000210260_200025704644 [0,1,1,0,0,0|1,0,1]=4 634 B11R1.28 [13CH3]OCCOc1ccccc1 7a_100000210260_200025704644 [0,1,1,0,0,0|1,0,1]=4 635 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [0,1,1,0,0,0|1,0,1]=4 636 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [0,1,1,0,0,0|1,0,1]=4 637 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [0,1,1,0,0,0|2,0,0]=4 638 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [0,1,1,0,0,0|2,0,0]=4 639 B11R1.91 C=C(F)COc1ccccc1 34a_100000210340_100009893438 [0,1,1,0,0,0|2,0,0]=4 640 B11R1.91 C=C(F)COc1ccccc1 7a_100000210340_100000042424 [0,1,1,0,0,0|2,0,0]=4 641 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,1,1,0,0,0|1,0,1]=4 642 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [0,1,1,0,0,0|1,0,1]=4 643 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [0,1,1,0,0,0|1,0,1]=4 644 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [0,1,1,0,0,0|1,0,1]=4 645 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [0,1,1,0,0,0|1,0,1]=4 646 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,1,1,0,0,0|1,0,1]=4 647 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,1,1,0,0,0|1,0,1]=4 648 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,1,1,0,0,0|1,0,1]=4 649 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,1,1,0,0,0|1,0,1]=4 650 B11R1.37 C=Cc1cc(ccc1OC)Br 271570a_100011290941_100012351588 [0,1,1,0,0,0|2,0,0]=4 651 B11R1.37 C=Cc1cc(ccc1OC)C 271570a_100011290941_100000186399 [0,1,1,0,0,0|2,0,0]=4 652 B11R1.37 C=Cc1cc(ccc1OC)Cl 271570a_100011290941_100011215930 [0,1,1,0,0,0|2,0,0]=4 653 B11R1.37 C=Cc1cc(ccc1OC)F 271570a_100011290941_100000171694 [0,1,1,0,0,0|2,0,0]=4 654 B11R1.37 C=Cc1cc(ccc1OC)N 271570a_100011290941_100000187427 [0,1,1,0,0,0|2,0,0]=4 655 B11R1.37 C=Cc1cc(ccc1OC)O 271570a_100011290941_100010084122 [0,1,1,0,0,0|2,0,0]=4 656 B11R1.37 C=Cc1ccc(cc1OC)Br 271570a_100011290941_100010245111 [0,1,1,0,0,0|2,0,0]=4 657 B11R1.37 C=Cc1ccc(cc1OC)C 271570a_100011290941_100010200004 [0,1,1,0,0,0|2,0,0]=4 658 B11R1.37 C=Cc1ccc(cc1OC)Cl 271570a_100011290941_100000050115 [0,1,1,0,0,0|2,0,0]=4 659 B11R1.37 C=Cc1ccc(cc1OC)F 271570a_100011290941_100000757151 [0,1,1,0,0,0|2,0,0]=4 660 B11R1.37 C=Cc1ccc(cc1OC)N 271570a_100011290941_100000765947 [0,1,1,0,0,0|2,0,0]=4 661 B11R1.37 C=Cc1ccc(cc1OC)O 271570a_100011290941_100011827694 [0,1,1,0,0,0|2,0,0]=4 662 B11R1.37 COc1cc(ccc1C=O)O 271570a_203496583355_100000697075 [0,1,1,0,0,0|1,0,1]=4 663 B11R1.37 COc1cc(ccc1CO)Br 34a_100000071718_200000210301 [0,1,1,0,0,0|1,0,1]=4 664 B11R1.37 COc1cc(ccc1CO)Br 7a_100000071718_200000210301 [0,1,1,0,0,0|1,0,1]=4 665 B11R1.37 COc1cc(ccc1CO)O 271570a_203496583355_100011277633 [0,1,1,0,0,0|1,0,1]=4 666 B11R1.37 COc1ccc(cc1C=O)O 271570a_203496583355_100000170026 [0,1,1,0,0,0|1,0,1]=4 667 B11R1.37 COc1ccc(cc1CO)Br 34a_100000184703_200000210301 [0,1,1,0,0,0|1,0,1]=4 668 B11R1.37 COc1ccc(cc1CO)Br 7a_100000184703_200000210301 [0,1,1,0,0,0|1,0,1]=4 669 B11R1.37 COc1ccc(cc1CO)C 34a_200011846009_200000210301 [0,1,1,0,0,0|1,0,1]=4 670 B11R1.37 COc1ccc(cc1CO)C 7a_200011846009_200000210301 [0,1,1,0,0,0|1,0,1]=4 671 B11R1.37 COc1ccc(cc1CO)Cl 34a_100011218961_200000210301 [0,1,1,0,0,0|1,0,1]=4 672 B11R1.37 COc1ccc(cc1CO)Cl 7a_100011218961_200000210301 [0,1,1,0,0,0|1,0,1]=4 673 B11R1.37 COc1ccc(cc1CO)F 34a_100011291448_200000210301 [0,1,1,0,0,0|1,0,1]=4 674 B11R1.37 COc1ccc(cc1CO)F 7a_100011291448_200000210301 [0,1,1,0,0,0|1,0,1]=4 675 B11R1.37 COc1ccc(cc1CO)I 34a_100000049520_200000210301 [0,1,1,0,0,0|1,0,1]=4 676 B11R1.37 COc1ccc(cc1CO)I 7a_100000049520_200000210301 [0,1,1,0,0,0|1,0,1]=4 677 B11R1.37 COc1ccc(cc1CO)O 271570a_203496583355_100000204679 [0,1,1,0,0,0|1,0,1]=4 678 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 34a_200011846009_200025704644 [0,1,1,0,0,0|1,0,1]=4 679 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 7a_200011846009_200025704644 [0,1,1,0,0,0|1,0,1]=4 680 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 34a_100000071718_200025704644 [0,1,1,0,0,0|1,0,1]=4 681 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 7a_100000071718_200025704644 [0,1,1,0,0,0|1,0,1]=4 682 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 34a_100000184703_200025704644 [0,1,1,0,0,0|1,0,1]=4 683 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 7a_100000184703_200025704644 [0,1,1,0,0,0|1,0,1]=4 684 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 34a_100011218961_200025704644 [0,1,1,0,0,0|1,0,1]=4 685 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 7a_100011218961_200025704644 [0,1,1,0,0,0|1,0,1]=4 686 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 34a_100011291448_200025704644 [0,1,1,0,0,0|1,0,1]=4 687 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 7a_100011291448_200025704644 [0,1,1,0,0,0|1,0,1]=4 688 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 34a_100000049520_200025704644 [0,1,1,0,0,0|1,0,1]=4 689 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 7a_100000049520_200025704644 [0,1,1,0,0,0|1,0,1]=4 690 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,1,1,0,0,0|2,0,0]=4 691 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,1,1,0,0,0|2,0,0]=4 692 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,1,1,0,0,0|2,0,0]=4 693 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,1,1,0,0,0|2,0,0]=4 694 B11R1.41 C=C=Cc1ccccc1OC 271570a_100015277604_100000174000 [0,1,1,0,0,0|2,0,0]=4 695 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [0,1,1,0,0,0|2,0,0]=4 696 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [0,1,1,0,0,0|2,0,0]=4 697 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [0,1,1,0,0,0|2,0,0]=4 698 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [0,1,1,0,0,0|2,0,0]=4 699 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,1,1,0,0,0|2,0,0]=4 700 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,1,1,0,0,0|2,0,0]=4 701 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,1,1,0,0,0|2,0,0]=4 702 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,1,1,0,0,0|2,0,0]=4 703 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,1,1,0,0,0|2,0,0]=4 704 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,1,1,0,0,0|2,0,0]=4 705 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,1,1,0,0,0|2,0,0]=4 706 B11R1.41 CCOc1ccccc1CO 34a_100011216872_100000210202 [0,1,1,0,0,0|1,0,1]=4 707 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [0,1,1,0,0,0|1,0,1]=4 708 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [0,1,1,0,0,0|1,0,1]=4 709 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,1,1,0,0,0|1,0,1]=4 710 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,1,1,0,0,0|1,0,1]=4 711 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,1,1,0,0,0|1,0,1]=4 712 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,1,1,0,0,0|1,0,1]=4 713 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,1,1,0,0,0|1,0,1]=4 714 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,1,1,0,0,0|1,0,1]=4 715 B11R1.41 COc1ccccc1CCO 34a_100000719421_200000210301 [0,1,1,0,0,0|1,0,1]=4 716 B11R1.41 COc1ccccc1CCO 7a_100000719421_200000210301 [0,1,1,0,0,0|1,0,1]=4 717 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,1,1,0,0,0|1,0,1]=4 718 B11R1.41 OCc1ccccc1OCF 34a_100011216872_100015361967 [0,1,1,0,0,0|1,0,1]=4 719 B11R1.41 [13CH3]Oc1ccccc1CCO 34a_100000719421_200025704644 [0,1,1,0,0,0|1,0,1]=4 720 B11R1.41 [13CH3]Oc1ccccc1CCO 7a_100000719421_200025704644 [0,1,1,0,0,0|1,0,1]=4 721 B11R1.53 C=C(C)c1ccccc1OC 271570a_100000694244_100000174000 [0,1,1,0,0,0|2,0,0]=4 722 B11R1.53 CC(O)c1ccccc1O[13CH3] 34a_200011232679_200025704644 [0,1,1,0,0,0|1,0,1]=4 723 B11R1.53 CC(O)c1ccccc1O[13CH3] 7a_200011232679_200025704644 [0,1,1,0,0,0|1,0,1]=4 724 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [0,1,1,0,0,0|1,0,1]=4 725 B11R1.53 COc1ccccc1C(=O)N 34a_100000192804_200000210301 [0,1,1,0,0,0|1,0,1]=4 726 B11R1.53 COc1ccccc1C(=O)N 7a_100000192804_200000210301 [0,1,1,0,0,0|1,0,1]=4 727 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [0,1,1,0,0,0|1,0,1]=4 728 B11R1.53 COc1ccccc1C(=O)[O-] 7a_100015234032_200000210301 [0,1,1,0,0,0|1,0,1]=4 729 B11R1.53 COc1ccccc1C(=S)N 7a_100000745089_200000210301 [0,1,1,0,0,0|1,1,0]=4 730 B11R1.53 COc1ccccc1C(C)O 34a_200011232679_200000210301 [0,1,1,0,0,0|1,0,1]=4 731 B11R1.53 COc1ccccc1C(C)O 7a_200011232679_200000210301 [0,1,1,0,0,0|1,0,1]=4 732 B11R1.53 CSc1ccccc1C(=O)O 62a_200000210301_100000734275 [0,1,1,0,0,0|1,1,0]=4 733 B11R1.53 CSc1ccccc1C(=O)O 62a_202125556159_200000210301 [0,1,1,0,0,0|1,1,0]=4 734 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 34a_100000192804_200025704644 [0,1,1,0,0,0|1,0,1]=4 735 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 7a_100000192804_200025704644 [0,1,1,0,0,0|1,0,1]=4 736 B11R1.53 [13CH3]Oc1ccccc1C(=O)[O-] 7a_100015234032_200025704644 [0,1,1,0,0,0|1,0,1]=4 737 B11R1.53 [13CH3]Oc1ccccc1C(=S)N 7a_100000745089_200025704644 [0,1,1,0,0,0|1,1,0]=4 738 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_200025704644_100000734275 [0,1,1,0,0,0|1,1,0]=4 739 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_202125556159_200025704644 [0,1,1,0,0,0|1,1,0]=4 740 B11R1.265 C=Cc1c(cccc1OC)Br 271570a_100011290941_100010131421 [0,1,1,0,0,0|2,0,0]=4 741 B11R1.265 C=Cc1c(cccc1OC)F 271570a_100011290941_100000041735 [0,1,1,0,0,0|2,0,0]=4 742 B11R1.265 C=Cc1c(cccc1OC)N 271570a_100011290941_100000703447 [0,1,1,0,0,0|2,0,0]=4 743 B11R1.265 C=Cc1c(cccc1OC)O 271570a_100011290941_100010202623 [0,1,1,0,0,0|2,0,0]=4 744 B11R1.265 C=Cc1cccc(c1OC)Br 271570a_100011290941_100010146560 [0,1,1,0,0,0|2,0,0]=4 745 B11R1.265 C=Cc1cccc(c1OC)C 271570a_100011290941_100010141385 [0,1,1,0,0,0|2,0,0]=4 746 B11R1.265 C=Cc1cccc(c1OC)Cl 271570a_100011290941_100010147678 [0,1,1,0,0,0|2,0,0]=4 747 B11R1.265 C=Cc1cccc(c1OC)F 271570a_100011290941_100009816759 [0,1,1,0,0,0|2,0,0]=4 748 B11R1.265 C=Cc1cccc(c1OC)N 271570a_100011290941_100011935253 [0,1,1,0,0,0|2,0,0]=4 749 B11R1.265 C=Cc1cccc(c1OC)O 271570a_100011290941_100010234590 [0,1,1,0,0,0|2,0,0]=4 750 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [0,1,1,0,0,0|1,0,1]=4 751 B11R1.265 COc1c(cccc1CO)F 34a_100011997349_200000210301 [0,1,1,0,0,0|1,0,1]=4 752 B11R1.265 COc1c(cccc1CO)F 7a_100011997349_200000210301 [0,1,1,0,0,0|1,0,1]=4 753 B11R1.265 COc1c(cccc1CO)O 271570a_203496583355_100000704359 [0,1,1,0,0,0|1,0,1]=4 754 B11R1.265 COc1cccc(c1C=O)O 271570a_203496583355_100009814803 [0,1,1,0,0,0|1,0,1]=4 755 B11R1.265 COc1cccc(c1CO)C 34a_200009874777_200000210301 [0,1,1,0,0,0|1,0,1]=4 756 B11R1.265 COc1cccc(c1CO)C 7a_200009874777_200000210301 [0,1,1,0,0,0|1,0,1]=4 757 B11R1.265 Cc1cccc(c1CO)O[13CH3] 34a_200009874777_200025704644 [0,1,1,0,0,0|1,0,1]=4 758 B11R1.265 Cc1cccc(c1CO)O[13CH3] 7a_200009874777_200025704644 [0,1,1,0,0,0|1,0,1]=4 759 B11R1.265 [13CH3]Oc1c(cccc1CO)F 34a_100011997349_200025704644 [0,1,1,0,0,0|1,0,1]=4 760 B11R1.265 [13CH3]Oc1c(cccc1CO)F 7a_100011997349_200025704644 [0,1,1,0,0,0|1,0,1]=4 761 B11R1.465 C=CCSc1c(noc1C)O 62a_100000210623_100010730664 [0,1,1,0,0,0|1,0,1]=4 762 B11R1.465 C=CCSc1c(noc1C)O 62a_100010730664_100000210623 [0,1,1,0,0,0|1,0,1]=4 763 B11R1.87 CC(C)(O)c1ccccc1O 271570a_203496583355_100011346021 [0,1,1,0,0,0|1,0,1]=4 764 B11R1.156 C=C(C)c1c(cccc1Br)O 271570a_100000694244_100010187912 [0,1,1,0,0,0|2,0,0]=4 765 B11R1.156 C=C(C)c1c(cccc1Cl)O 271570a_100000694244_100000050174 [0,1,1,0,0,0|2,0,0]=4 766 B11R1.156 C=C(C)c1c(cccc1F)O 271570a_100000694244_100009820682 [0,1,1,0,0,0|2,0,0]=4 767 B11R1.156 C=C(C)c1c(cccc1O)C 271570a_100000694244_100000686692 [0,1,1,0,0,0|2,0,0]=4 768 B11R1.156 C=C(C)c1c(cccc1O)N 271570a_100000694244_100012183704 [0,1,1,0,0,0|2,0,0]=4 769 B11R1.156 C=C(C)c1c(cccc1O)O 271570a_100000694244_100010205330 [0,1,1,0,0,0|2,0,0]=4 770 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [0,1,1,0,0,0|1,0,1]=4 771 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [0,1,1,0,0,0|1,0,1]=4 772 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [0,1,1,0,0,0|1,0,1]=4 773 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [0,1,1,0,0,0|1,0,1]=4 774 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [0,1,1,0,0,0|1,0,1]=4 775 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [0,1,1,0,0,0|1,0,1]=4 776 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [0,1,1,0,0,0|1,0,1]=4 777 B11R1.156 CC(O)c1c(cccc1F)O 271570a_203496583355_100013085324 [0,1,1,0,0,0|1,0,1]=4 778 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [0,1,1,0,0,0|1,0,1]=4 779 B11R1.156 NC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010147686 [0,1,1,0,0,0|0,0,2]=4 780 B11R1.156 NC(=O)c1c(cccc1F)O 271570a_203496583355_100011219063 [0,1,1,0,0,0|0,0,2]=4 781 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [0,1,1,0,0,0|1,0,1]=4 782 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [0,1,1,0,0,0|1,0,1]=4 783 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [0,1,1,0,0,0|1,0,1]=4 784 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [0,1,1,0,0,0|1,0,1]=4 785 B11R1.159 C=C(C)c1cccc(c1O)Br 271570a_100000694244_100010084509 [0,1,1,0,0,0|2,0,0]=4 786 B11R1.159 C=C(C)c1cccc(c1O)C 271570a_100000694244_100009817157 [0,1,1,0,0,0|2,0,0]=4 787 B11R1.159 C=C(C)c1cccc(c1O)Cl 271570a_100000694244_100010202889 [0,1,1,0,0,0|2,0,0]=4 788 B11R1.159 C=C(C)c1cccc(c1O)F 271570a_100000694244_100009813666 [0,1,1,0,0,0|2,0,0]=4 789 B11R1.159 C=C(C)c1cccc(c1O)N 271570a_100000694244_100011934915 [0,1,1,0,0,0|2,0,0]=4 790 B11R1.159 C=C(C)c1cccc(c1O)O 271570a_100000694244_100009815950 [0,1,1,0,0,0|2,0,0]=4 791 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,1,1,0,0,0|1,0,1]=4 792 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,1,1,0,0,0|1,0,1]=4 793 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,1,1,0,0,0|1,0,1]=4 794 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,1,1,0,0,0|1,0,1]=4 795 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,1,1,0,0,0|1,0,1]=4 796 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,1,1,0,0,0|1,0,1]=4 797 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,1,1,0,0,0|1,0,1]=4 798 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,1,1,0,0,0|0,0,2]=4 799 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,1,1,0,0,0|1,0,1]=4 800 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [0,1,1,0,0,0|0,0,2]=4 801 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,1,1,0,0,0|1,0,1]=4 802 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,1,1,0,0,0|1,0,1]=4 803 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,1,1,0,0,0|1,0,1]=4 804 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,1,1,0,0,0|1,0,1]=4 805 B11R1.166 C=C(C)c1ccc(cc1O)Br 271570a_100000694244_100012344904 [0,1,1,0,0,0|2,0,0]=4 806 B11R1.166 C=C(C)c1ccc(cc1O)C 271570a_100000694244_100012002257 [0,1,1,0,0,0|2,0,0]=4 807 B11R1.166 C=C(C)c1ccc(cc1O)Cl 271570a_100000694244_100000050036 [0,1,1,0,0,0|2,0,0]=4 808 B11R1.166 C=C(C)c1ccc(cc1O)F 271570a_100000694244_100000690578 [0,1,1,0,0,0|2,0,0]=4 809 B11R1.166 C=C(C)c1ccc(cc1O)O 271570a_100000694244_100009813921 [0,1,1,0,0,0|2,0,0]=4 810 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,1,0,0,0|1,0,1]=4 811 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,1,0,0,0|1,0,1]=4 812 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,1,0,0,0|1,0,1]=4 813 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,1,0,0,0|1,0,1]=4 814 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,1,0,0,0|1,0,1]=4 815 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,1,0,0,0|1,0,1]=4 816 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,1,0,0,0|1,0,1]=4 817 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,1,0,0,0|1,0,1]=4 818 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,1,0,0,0|1,0,1]=4 819 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,1,0,0,0|1,0,1]=4 820 B11R1.166 Cc1ccc(c(c1)O)B(O)O 271570a_203496583355_200011068827 [0,1,1,0,0,0|2,0,0]=4 821 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,1,0,0,0|1,0,1]=4 822 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [0,1,1,0,0,0|0,0,2]=4 823 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [0,1,1,0,0,0|0,0,2]=4 824 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [0,1,1,0,0,0|0,0,2]=4 825 B11R1.166 OB(O)c1ccc(cc1O)F 271570a_203496583355_100010175514 [0,1,1,0,0,0|2,0,0]=4 826 B11R1.166 OB(O)c1ccc(cc1O)O 271570a_203496583355_100010158982 [0,1,1,0,0,0|2,0,0]=4 827 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,1,0,0,0|1,0,1]=4 828 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,1,0,0,0|1,0,1]=4 829 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,1,0,0,0|1,0,1]=4 830 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,1,0,0,0|1,0,1]=4 831 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,1,0,0,0|1,0,1]=4 832 B11R1.167 C=C(C)c1cc(ccc1O)Br 271570a_100000694244_100012355227 [0,1,1,0,0,0|2,0,0]=4 833 B11R1.167 C=C(C)c1cc(ccc1O)C 271570a_100000694244_100000765521 [0,1,1,0,0,0|2,0,0]=4 834 B11R1.167 C=C(C)c1cc(ccc1O)Cl 271570a_100000694244_100011356953 [0,1,1,0,0,0|2,0,0]=4 835 B11R1.167 C=C(C)c1cc(ccc1O)F 271570a_100000694244_100000211999 [0,1,1,0,0,0|2,0,0]=4 836 B11R1.167 C=C(C)c1cc(ccc1O)N 271570a_100000694244_100011534360 [0,1,1,0,0,0|2,0,0]=4 837 B11R1.167 C=C(C)c1cc(ccc1O)O 271570a_100000694244_100009813629 [0,1,1,0,0,0|2,0,0]=4 838 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,1,1,0,0,0|1,0,1]=4 839 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,1,1,0,0,0|1,0,1]=4 840 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,1,1,0,0,0|1,0,1]=4 841 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,1,1,0,0,0|1,0,1]=4 842 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,1,1,0,0,0|1,0,1]=4 843 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,1,1,0,0,0|1,0,1]=4 844 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,1,1,0,0,0|1,0,1]=4 845 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,1,1,0,0,0|1,0,1]=4 846 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,1,1,0,0,0|1,0,1]=4 847 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,1,1,0,0,0|1,0,1]=4 848 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,1,1,0,0,0|1,0,1]=4 849 B11R1.167 C[C@H](O)c1cc(ccc1O)F 271570a_203496583355_100134768474 [0,1,1,0,0,0|1,0,1]=4 850 B11R1.167 Cc1ccc(c(c1)B(O)O)O 271570a_203496583355_200010883979 [0,1,1,0,0,0|2,0,0]=4 851 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,1,1,0,0,0|0,0,2]=4 852 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,1,1,0,0,0|1,0,1]=4 853 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [0,1,1,0,0,0|0,0,2]=4 854 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [0,1,1,0,0,0|0,0,2]=4 855 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [0,1,1,0,0,0|0,0,2]=4 856 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [0,1,1,0,0,0|0,0,2]=4 857 B11R1.167 OB(O)c1cc(ccc1O)F 271570a_203496583355_200009816908 [0,1,1,0,0,0|2,0,0]=4 858 B11R1.167 OB(O)c1cc(ccc1O)O 271570a_203496583355_200009814749 [0,1,1,0,0,0|2,0,0]=4 859 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,1,1,0,0,0|1,0,1]=4 860 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,1,1,0,0,0|1,0,1]=4 861 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,1,1,0,0,0|1,0,1]=4 862 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,1,1,0,0,0|1,0,1]=4 863 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,1,1,0,0,0|1,0,1]=4 864 B11R1.495 CC(=Cc1c(noc1C)O)C 271570a_100102525489_100010730664 [0,1,1,0,0,0|0,0,2]=4 865 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [1,1,0,0,0,0|2,0,0]=4 866 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,1,0,0,0,0|1,0,0]=3 867 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [1,1,0,0,0,0|1,1,0]=4 868 B11R2.36 Oc1cc2[nH]ncc2cn1 271570a_203496583355_100009872621 [1,1,0,0,0,0|2,0,0]=4 869 B11R2.36 Oc1cc2cn[nH]c2cn1 271570a_203496583355_100009820118 [1,1,0,0,0,0|2,0,0]=4 870 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,1,0,0,0,0|2,0,0]=4 871 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,1,0,0,0,0|1,0,0]=3 872 B11R2.36 Oc1ccc2[nH]ncc2n1 271570a_203496583355_100000082131 [1,1,0,0,0,0|2,0,0]=4 873 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,1,0,0,0,0|2,0,0]=4 874 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,1,0,0,0,0|2,0,0]=4 875 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,1,0,0,0,0|1,0,1]=4 876 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,1,0,0,0,0|1,0,1]=4 877 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,1,0,0,0,0|2,0,0]=4 878 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,1,0,0,0,0|2,0,0]=4 879 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,1,0,0,0,0|1,0,0]=3 880 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,1,0,0,0,0|1,1,0]=4 881 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,1,0,0,0,0|1,0,0]=3 882 B11R2.36 Oc1ccc2cn[nH]c2n1 271570a_203496583355_100009883947 [1,1,0,0,0,0|2,0,0]=4 883 B11R2.36 Oc1ccc2cncn2c1 271570a_203496583355_100009887162 [1,1,0,0,0,0|2,0,0]=4 884 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,1,0,0,0,0|0,0,0]=2 885 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,1,0,0,0,0|2,0,0]=4 886 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,1,0,0,0,0|2,0,0]=4 887 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,1,0,0,0,0|2,0,0]=4 888 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [1,1,0,0,0,0|2,0,0]=4 889 B11R2.36 Oc1ccc2nncn2c1 271570a_203496583355_100000764363 [1,1,0,0,0,0|2,0,0]=4 890 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,1,0,0,0,0|1,0,0]=3 891 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [1,1,0,0,0,0|2,0,0]=4 892 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,1,0,0,0,0|2,0,0]=4 893 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,1,0,0,0,0|0,0,0]=2 894 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,1,0,0,0,0|1,1,0]=4 895 B11R2.36 Oc1ccn2cnnc2c1 271570a_203496583355_100009819662 [1,1,0,0,0,0|2,0,0]=4 896 B11R2.36 Oc1ccn2nncc2c1 271570a_203496583355_100009820036 [1,1,0,0,0,0|2,0,0]=4 897 B11R2.36 Oc1cnc2[nH]ncc2c1 271570a_203496583355_100009814530 [1,1,0,0,0,0|2,0,0]=4 898 B11R2.36 Oc1cnc2cn[nH]c2c1 271570a_203496583355_100009844038 [1,1,0,0,0,0|2,0,0]=4 899 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,1,0,0,0,0|2,0,0]=4 900 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,1,0,0,0,0|1,0,1]=4 901 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,1,0,0,0,0|1,0,1]=4 902 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [1,1,0,0,0,0|2,0,0]=4 903 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,1,0,0,0,0|2,0,0]=4 904 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,1,0,0,0,0|1,0,0]=3 905 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [1,1,0,0,0,0|2,0,0]=4 906 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,1,0,0,0,0|2,0,0]=4 907 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,1,0,0,0,0|1,0,0]=3 908 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,1,0,0,0,0|1,1,0]=4 909 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [1,1,0,0,0,0|1,0,0]=3 910 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,1,0,0,0,0|0,0,0]=2 911 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,1,0,0,0,0|2,0,0]=4 912 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,1,0,0,0,0|1,0,0]=3 913 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,1,0,0,0,0|2,0,0]=4 914 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,1,0,0,0,0|0,0,0]=2 915 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,1,0,0,0,0|1,1,0]=4 916 B11R2.106 Oc1cccc2n1cnc2 271570a_203496583355_100009817730 [1,1,0,0,0,0|2,0,0]=4 917 B11R2.106 Oc1cccc2n1cnn2 271570a_203496583355_100009819885 [1,1,0,0,0,0|2,0,0]=4 918 B11R2.106 Oc1cccn2c1cnc2 271570a_203496583355_100009857155 [1,1,0,0,0,0|2,0,0]=4 919 B11R2.106 Oc1cccn2c1nnc2 271570a_203496583355_100000764285 [1,1,0,0,0,0|2,0,0]=4 920 B11R2.106 Oc1ccnc2c1[nH]nc2 271570a_203496583355_100000112858 [1,1,0,0,0,0|2,0,0]=4 921 B11R2.106 Oc1ccnc2c1cn[nH]2 271570a_203496583355_100009819725 [1,1,0,0,0,0|2,0,0]=4 922 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [1,1,0,0,0,0|2,0,0]=4 923 B11R2.106 Oc1cncc2c1[nH]nc2 271570a_203496583355_100009857261 [1,1,0,0,0,0|2,0,0]=4 924 B11R2.106 Oc1cncc2c1cn[nH]2 271570a_203496583355_100009819959 [1,1,0,0,0,0|2,0,0]=4 925 B11R2.106 Oc1nccc2c1[nH]nc2 271570a_203496583355_100009852419 [1,1,0,0,0,0|2,0,0]=4 926 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [1,1,0,0,0,0|2,0,0]=4 927 B11R2.106 Oc1nccc2c1cn[nH]2 271570a_203496583355_100102525074 [1,1,0,0,0,0|2,0,0]=4 928 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,1|2,0,0]=4 929 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,1|2,0,0]=4 930 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,1,0,0,0,1|2,0,0]=4 931 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,1,0,0,0,1|1,0,0]=3 932 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,1,0,0,0,1|2,0,0]=4 933 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,1|2,0,0]=4 934 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,1,0,0,0,1|1,0,0]=3 935 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,1|2,0,0]=4 936 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,1|2,0,0]=4 937 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,1|2,0,0]=4 938 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,1|2,0,0]=4 939 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,1,0,0,0,1|2,0,0]=4 940 B13R2.32 Oc1nnc2ccccc2c1O 271570a_203496583355_100000688347 [0,1,0,0,0,1|1,0,0]=3 941 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [0,1,0,0,0,1|2,0,0]=4 942 B13R2.57 C=Cc1ncc2ccccc2n1 271570a_100011290941_100000097389 [0,1,0,0,0,1|2,0,0]=4 943 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [0,1,0,0,0,1|2,0,0]=4 944 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,1,0,0,0,1|2,0,0]=4 945 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,1,0,0,0,1|2,0,0]=4 946 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,1,0,0,0,1|2,0,0]=4 947 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,1,0,0,0,1|2,0,0]=4 948 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [0,1,0,0,0,1|1,1,0]=4 949 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [0,1,0,0,0,1|1,1,0]=4 950 B13R2.57 CSc1ncc2ccccc2n1 62a_200000210301_100000097389 [0,1,0,0,0,1|1,1,0]=4 951 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,1,0,0,0,1|2,0,0]=4 952 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,1,0,0,0,1|2,0,0]=4 953 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,1,0,0,0,1|2,0,0]=4 954 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,1,0,0,0,1|2,0,0]=4 955 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [0,1,0,0,0,1|1,1,0]=4 956 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [0,1,0,0,0,1|1,1,0]=4 957 B13R2.57 [13CH3]Sc1ncc2ccccc2n1 62a_200025704644_100000097389 [0,1,0,0,0,1|1,1,0]=4 958 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [0,1,0,0,0,1|2,0,0]=4 959 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [0,1,0,0,0,1|2,0,0]=4 960 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [0,1,0,0,0,1|2,0,0]=4 961 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [0,1,0,0,0,1|2,0,0]=4 962 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [0,1,0,0,0,1|2,0,0]=4 963 B13R2.155 Nc1ncc2ccc(cc2n1)O 271570a_203496583355_100010199760 [0,1,0,0,0,1|2,0,0]=4 964 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,0,0,1|1,0,1]=4 965 B13R2.155 O=c1ccc2cnc(cc2[nH]1)O 271570a_203496583355_100010563892 [0,1,0,0,0,1|2,0,0]=4 966 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [0,1,0,0,0,1|1,0,0]=3 967 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [0,1,0,0,0,1|2,0,0]=4 968 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [0,1,0,0,0,1|2,0,0]=4 969 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [0,1,0,0,0,1|2,0,0]=4 970 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [0,1,0,0,0,1|2,0,0]=4 971 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [0,1,0,0,0,1|1,0,0]=3 972 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [0,1,0,0,0,1|2,0,0]=4 973 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [0,1,0,0,0,1|2,0,0]=4 974 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [0,1,0,0,0,1|2,0,0]=4 975 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [0,1,0,0,0,1|2,0,0]=4 976 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [0,1,0,0,0,1|2,0,0]=4 977 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [0,1,0,0,0,1|2,0,0]=4 978 B13R2.155 Oc1ncc2ccc(cc2n1)F 271570a_203496583355_100000104070 [0,1,0,0,0,1|1,0,0]=3 979 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,1|2,0,0]=4 980 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,1|2,0,0]=4 981 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,1|2,0,0]=4 982 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,1|2,0,0]=4 983 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [0,1,0,0,0,1|2,0,0]=4 984 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,1|2,0,0]=4 985 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,1|2,0,0]=4 986 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,1|2,0,0]=4 987 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,1|2,0,0]=4 988 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,1|2,0,0]=4 989 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [0,1,0,0,0,1|1,0,0]=3 990 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,1|2,0,0]=4 991 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,0,0,1|2,0,0]=4 992 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [0,1,0,0,0,1|2,0,0]=4 993 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [0,1,0,0,0,1|1,0,0]=3 994 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,1|2,0,0]=4 995 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [0,1,0,0,0,1|2,0,0]=4 996 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [0,1,0,0,0,1|2,0,0]=4 997 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [0,1,0,0,0,1|1,0,0]=3 998 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,1|2,0,0]=4 999 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,1|2,0,0]=4 1000 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,1|2,0,0]=4 1001 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [0,1,0,0,0,1|2,0,0]=4 1002 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,1,0,0,0,1|2,0,0]=4 1003 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [0,1,0,0,0,1|2,0,0]=4 1004 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [0,1,0,0,0,1|2,0,0]=4 1005 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [0,1,0,0,0,1|2,0,0]=4 1006 B13R2.369 Nc1nc2ccccc2nc1O 271570a_203496583355_100000009970 [0,1,0,0,0,1|2,0,0]=4 1007 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,1,0,0,0,1|1,0,0]=3 1008 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [0,1,0,0,0,1|2,0,0]=4 1009 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [0,1,0,0,0,1|2,0,0]=4 1010 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [0,1,0,0,0,1|2,0,0]=4 1011 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [0,1,0,0,0,1|2,0,0]=4 1012 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [0,1,0,0,0,1|2,0,0]=4 1013 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [0,1,0,0,0,1|2,0,0]=4 1014 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [0,1,0,0,0,1|2,0,0]=4 1015 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [0,1,0,0,0,1|2,0,0]=4 1016 B13R2.3683 Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100011865911 [0,1,0,0,0,1|2,0,0]=4 1017 B13R2.3683 Nc1cc2ccc(cc2cn1)O 271570a_203496583355_100010232990 [0,1,0,0,0,1|2,0,0]=4 1018 B13R2.3683 Nc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185457 [0,1,0,0,0,1|2,0,0]=4 1019 B13R2.3683 Nc1ccc2cc(cnc2c1)O 271570a_203496583355_200010264087 [0,1,0,0,0,1|2,0,0]=4 1020 B13R2.3683 Nc1ccc2nc(cnc2c1)O 271570a_203496583355_100009885871 [0,1,0,0,0,1|2,0,0]=4 1021 B13R2.3683 Nc1ncc2cc(ccc2n1)O 271570a_203496583355_100010138702 [0,1,0,0,0,1|2,0,0]=4 1022 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,1,0,0,0,1|1,0,1]=4 1023 B13R2.3683 Oc1ccc2cc(ccc2c1)Br 271570a_203496583355_100012344972 [0,1,0,0,0,1|2,0,0]=4 1024 B13R2.3683 Oc1ccc2cc(ccc2c1)F 271570a_203496583355_100009817052 [0,1,0,0,0,1|2,0,0]=4 1025 B13R2.3683 Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185455 [0,1,0,0,0,1|2,0,0]=4 1026 B13R2.3683 Oc1ccc2cc(ccc2n1)F 271570a_203496583355_100011998705 [0,1,0,0,0,1|2,0,0]=4 1027 B13R2.3683 Oc1ccc2nc(ccc2c1)O 271570a_203496583355_100009849208 [0,1,0,0,0,1|2,0,0]=4 1028 B13R2.3683 Oc1ccc2nc(cnc2c1)O 271570a_203496583355_200010664160 [0,1,0,0,0,1|2,0,0]=4 1029 B13R2.3683 Oc1cnc2cc(ccc2c1)Cl 271570a_203496583355_100015716233 [0,1,0,0,0,1|2,0,0]=4 1030 B13R2.3683 Oc1cnc2cc(ccc2c1)O 271570a_203496583355_200010153753 [0,1,0,0,0,1|2,0,0]=4 1031 B13R2.3683 Oc1cnc2cc(ccc2n1)F 271570a_203496583355_100000098432 [0,1,0,0,0,1|2,0,0]=4 1032 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,1|2,0,0]=4 1033 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [0,1,0,0,0,1|2,0,0]=4 1034 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,1|2,0,0]=4 1035 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,1|2,0,0]=4 1036 B13R2.5179 Nc1ncc2c(cccc2n1)O 271570a_203496583355_100010209551 [0,1,0,0,0,1|2,0,0]=4 1037 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,1|1,0,1]=4 1038 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,1,0,0,0,1|1,0,0]=3 1039 B13R2.5179 Oc1cc2ccnc(c2cn1)O 271570a_203496583355_100020669822 [0,1,0,0,0,1|2,0,0]=4 1040 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,1|2,0,0]=4 1041 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,1|2,0,0]=4 1042 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,1|2,0,0]=4 1043 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,1|2,0,0]=4 1044 B13R2.342 Cc1cccc2c1ccnc2O 271570a_203496583355_100012002547 [0,1,0,0,0,1|1,0,0]=3 1045 B13R2.342 Cc1cccc2c1nccc2O 271570a_203496583355_100000751276 [0,1,0,0,0,1|2,0,0]=4 1046 B13R2.342 Cc1cccc2c1ncnc2O 271570a_203496583355_100000751292 [0,1,0,0,0,1|1,0,0]=3 1047 B13R2.342 Cc1nccc2c1cccc2O 271570a_203496583355_100010137443 [0,1,0,0,0,1|2,0,0]=4 1048 B13R2.342 Nc1cccc2c1cccc2O 271570a_203496583355_100009816864 [0,1,0,0,0,1|2,0,0]=4 1049 B13R2.342 Nc1cccc2c1ccnc2O 271570a_203496583355_100000070072 [0,1,0,0,0,1|1,0,0]=3 1050 B13R2.342 Nc1cccc2c1nccc2O 271570a_203496583355_100009892510 [0,1,0,0,0,1|2,0,0]=4 1051 B13R2.342 Nc1nccc2c1cccc2O 271570a_203496583355_103549770558 [0,1,0,0,0,1|2,0,0]=4 1052 B13R2.342 Nc1ncnc2c1cccc2O 271570a_203496583355_100010199759 [0,1,0,0,0,1|2,0,0]=4 1053 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [0,1,0,0,0,1|1,0,1]=4 1054 B13R2.342 Oc1cccc2c1cccc2F 271570a_203496583355_100009817034 [0,1,0,0,0,1|2,0,0]=4 1055 B13R2.342 Oc1cccc2c1cccc2O 271570a_203496583355_100010003857 [0,1,0,0,0,1|2,0,0]=4 1056 B13R2.342 Oc1cccc2c1ccnc2Cl 271570a_203496583355_100010080171 [0,1,0,0,0,1|2,0,0]=4 1057 B13R2.342 Oc1ccnc2c1cccc2F 271570a_203496583355_100011934723 [0,1,0,0,0,1|2,0,0]=4 1058 B13R2.342 Oc1ccnc2c1cccc2O 271570a_203496583355_100000703299 [0,1,0,0,0,1|2,0,0]=4 1059 B13R2.342 Oc1cncc2c1cccc2F 271570a_203496583355_100010740057 [0,1,0,0,0,1|1,0,0]=3 1060 B13R2.342 Oc1nccc2c1cccc2F 271570a_203496583355_100012180906 [0,1,0,0,0,1|1,0,0]=3 1061 B13R2.342 Oc1ncnc2c1cccc2F 271570a_203496583355_100000693626 [0,1,0,0,0,1|1,0,0]=3 1062 B13R2.342 Oc1ncnc2c1cccc2O 271570a_203496583355_100010201916 [0,1,0,0,0,1|1,0,0]=3 1063 B13R2.371 Cc1ccc(c2c1cccc2)O 271570a_203496583355_100011215156 [0,1,0,0,0,1|2,0,0]=4 1064 B13R2.371 Cc1cnc(c2c1cccc2)O 271570a_203496583355_100000112005 [0,1,0,0,0,1|1,0,0]=3 1065 B13R2.371 Cc1ncc(c2c1cccc2)O 271570a_203496583355_100010239772 [0,1,0,0,0,1|1,0,0]=3 1066 B13R2.371 Cc1nnc(c2c1cccc2)O 271570a_203496583355_100000189618 [0,1,0,0,0,1|1,0,0]=3 1067 B13R2.371 Nc1ccc(c2c1cccc2)O 271570a_203496583355_100000766797 [0,1,0,0,0,1|2,0,0]=4 1068 B13R2.371 Nc1cnc(c2c1cccc2)O 271570a_203496583355_200009868590 [0,1,0,0,0,1|1,0,0]=3 1069 B13R2.371 Nc1ncc(c2c1cccc2)O 271570a_203496583355_100010158575 [0,1,0,0,0,1|1,0,0]=3 1070 B13R2.371 Nc1ncc(c2c1cccn2)O 271570a_203496583355_100010383929 [0,1,0,0,0,1|2,0,0]=4 1071 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [0,1,0,0,0,1|1,0,0]=3 1072 B13R2.371 O=c1[nH]nc(c2c1cccn2)O 271570a_203496583355_200021304518 [0,1,0,0,0,1|2,0,0]=4 1073 B13R2.371 O=c1[nH]nc(c2c1nccc2)O 271570a_203496583355_100021647086 [0,1,0,0,0,1|2,0,0]=4 1074 B13R2.371 Oc1ccc(c2c1cccc2)Br 271570a_203496583355_100012339872 [0,1,0,0,0,1|2,0,0]=4 1075 B13R2.371 Oc1ccc(c2c1cccc2)F 271570a_203496583355_100011218216 [0,1,0,0,0,1|2,0,0]=4 1076 B13R2.371 Oc1ccc(c2c1cccc2)O 271570a_203496583355_100000186334 [0,1,0,0,0,1|2,0,0]=4 1077 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100000067196 [0,1,0,0,0,1|1,0,0]=3 1078 B13R2.371 Oc1cnc(c2c1cccc2)O 271570a_203496583355_100009816523 [0,1,0,0,0,1|1,0,0]=3 1079 B13R2.371 [O-][n+]1ccc(c2c1cccc2)O 271570a_203496583355_100020656173 [0,1,0,0,0,1|2,0,0]=4 1080 B13R2.1613 C=Cc1cncc2c1cccc2 271570a_100011290941_100000187577 [0,1,0,0,0,1|2,0,0]=4 1081 B13R2.1613 C=Cc1cnnc2c1cccc2 271570a_100011290941_100000063506 [0,1,0,0,0,1|2,0,0]=4 1082 B13R2.1613 C=Cc1nccc2c1cccc2 271570a_100011290941_100011934041 [0,1,0,0,0,1|2,0,0]=4 1083 B13R2.1613 C=Cc1ncnc2c1cccc2 271570a_100011290941_100000217608 [0,1,0,0,0,1|2,0,0]=4 1084 B13R2.1613 CNc1cnnc2c1cccc2 27a_100102657272_100000063506 [0,1,0,0,0,1|2,0,0]=4 1085 B13R2.1613 CNc1nccc2c1cccc2 27a_100102657272_100011934041 [0,1,0,0,0,1|2,0,0]=4 1086 B13R2.1613 CNc1ncnc2c1cccc2 27a_100102657272_100000217608 [0,1,0,0,0,1|2,0,0]=4 1087 B13R2.1613 COC1CCOc2c1cccc2 7a_100000708930_200000210301 [0,1,0,0,0,1|1,0,1]=4 1088 B13R2.1613 COC1COCc2c1cccc2 34a_100012179175_200000210301 [0,1,0,0,0,1|1,0,1]=4 1089 B13R2.1613 COc1cccc2c1cccc2 34a_100000210388_200000210301 [0,1,0,0,0,1|2,0,0]=4 1090 B13R2.1613 COc1cccc2c1cccc2 7a_100000210388_200000210301 [0,1,0,0,0,1|2,0,0]=4 1091 B13R2.1613 COc1cncc2c1cccc2 34a_100000066178_200000210301 [0,1,0,0,0,1|1,0,0]=3 1092 B13R2.1613 COc1cncc2c1cccc2 7a_100000066178_200000210301 [0,1,0,0,0,1|1,0,0]=3 1093 B13R2.1613 COc1nccc2c1cccc2 34a_102531767632_200000210301 [0,1,0,0,0,1|1,0,0]=3 1094 B13R2.1613 CSc1cncc2c1cccc2 62a_100000187577_200000210301 [0,1,0,0,0,1|1,1,0]=4 1095 B13R2.1613 CSc1cncc2c1cccc2 62a_200000210301_100000187577 [0,1,0,0,0,1|1,1,0]=4 1096 B13R2.1613 CSc1cnnc2c1cccc2 62a_200000210301_100000063506 [0,1,0,0,0,1|1,1,0]=4 1097 B13R2.1613 CSc1nccc2c1cccc2 62a_100011934041_200000210301 [0,1,0,0,0,1|1,1,0]=4 1098 B13R2.1613 CSc1nccc2c1cccc2 62a_200000210301_100011934041 [0,1,0,0,0,1|1,1,0]=4 1099 B13R2.1613 CSc1ncnc2c1cccc2 62a_100000753007_200000210301 [0,1,0,0,0,1|1,1,0]=4 1100 B13R2.1613 CSc1ncnc2c1cccc2 62a_200000210301_100000217608 [0,1,0,0,0,1|1,1,0]=4 1101 B13R2.1613 CSc1nncc2c1cccc2 62a_200000210301_100025712358 [0,1,0,0,0,1|1,1,0]=4 1102 B13R2.1613 [13CH3]OC1CCOc2c1cccc2 7a_100000708930_200025704644 [0,1,0,0,0,1|1,0,1]=4 1103 B13R2.1613 [13CH3]OC1COCc2c1cccc2 34a_100012179175_200025704644 [0,1,0,0,0,1|1,0,1]=4 1104 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 34a_100000210388_200025704644 [0,1,0,0,0,1|2,0,0]=4 1105 B13R2.1613 [13CH3]Oc1cccc2c1cccc2 7a_100000210388_200025704644 [0,1,0,0,0,1|2,0,0]=4 1106 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 34a_100000066178_200025704644 [0,1,0,0,0,1|1,0,0]=3 1107 B13R2.1613 [13CH3]Oc1cncc2c1cccc2 7a_100000066178_200025704644 [0,1,0,0,0,1|1,0,0]=3 1108 B13R2.1613 [13CH3]Oc1nccc2c1cccc2 34a_102531767632_200025704644 [0,1,0,0,0,1|1,0,0]=3 1109 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_100000187577_200025704644 [0,1,0,0,0,1|1,1,0]=4 1110 B13R2.1613 [13CH3]Sc1cncc2c1cccc2 62a_200025704644_100000187577 [0,1,0,0,0,1|1,1,0]=4 1111 B13R2.1613 [13CH3]Sc1cnnc2c1cccc2 62a_200025704644_100000063506 [0,1,0,0,0,1|1,1,0]=4 1112 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_100011934041_200025704644 [0,1,0,0,0,1|1,1,0]=4 1113 B13R2.1613 [13CH3]Sc1nccc2c1cccc2 62a_200025704644_100011934041 [0,1,0,0,0,1|1,1,0]=4 1114 B13R2.1613 [13CH3]Sc1ncnc2c1cccc2 62a_100000753007_200025704644 [0,1,0,0,0,1|1,1,0]=4 1115 B13R2.1613 [13CH3]Sc1ncnc2c1cccc2 62a_200025704644_100000217608 [0,1,0,0,0,1|1,1,0]=4 1116 B13R2.1613 [13CH3]Sc1nncc2c1cccc2 62a_200025704644_100025712358 [0,1,0,0,0,1|1,1,0]=4 1117 B13R2.4818 Cc1cccc2c1c(ccc2)O 271570a_203496583355_100009995290 [0,1,0,0,0,1|2,0,0]=4 1118 B13R2.4818 Cc1cncc2c1c(ccc2)O 271570a_203496583355_100009817140 [0,1,0,0,0,1|2,0,0]=4 1119 B13R2.4818 Nc1cccc2c1c(ccc2)O 271570a_203496583355_100010002837 [0,1,0,0,0,1|2,0,0]=4 1120 B13R2.4818 Nc1cccc2c1c(ccn2)O 271570a_203496583355_100010263589 [0,1,0,0,0,1|2,0,0]=4 1121 B13R2.4818 Nc1cccc2c1c(cnc2)O 271570a_203496583355_100000720362 [0,1,0,0,0,1|1,0,0]=3 1122 B13R2.4818 Nc1nccc2c1c(ccc2)O 271570a_203496583355_100010291105 [0,1,0,0,0,1|2,0,0]=4 1123 B13R2.4818 Nc1ncnc2c1c(ccc2)O 271570a_203496583355_100010171649 [0,1,0,0,0,1|2,0,0]=4 1124 B13R2.4818 O=C1CCOc2c1c(ccc2)O 271570a_203496583355_100010205896 [0,1,0,0,0,1|1,0,1]=4 1125 B13R2.4818 Oc1cccc2c1c(ccc2)Br 271570a_203496583355_100010243825 [0,1,0,0,0,1|2,0,0]=4 1126 B13R2.4818 Oc1cccc2c1c(ccc2)F 271570a_203496583355_100010177852 [0,1,0,0,0,1|2,0,0]=4 1127 B13R2.4818 Oc1cccc2c1c(ccc2)O 271570a_203496583355_100010089961 [0,1,0,0,0,1|2,0,0]=4 1128 B13R2.4818 Oc1cccc2c1c(ccn2)O 271570a_203496583355_100010187735 [0,1,0,0,0,1|2,0,0]=4 1129 B13R2.4818 Oc1cccc2c1c(ncc2)O 271570a_203496583355_100010162479 [0,1,0,0,0,1|1,0,0]=3 1130 B13R2.4818 Oc1ncnc2c1c(ccc2)F 271570a_203496583355_100000743342 [0,1,0,0,0,1|1,0,0]=3 1131 B13R2.1 C=C=Cc1coc2c1cccc2 271570a_100015277604_100009812202 [0,2,0,0,0,0|2,0,0]=4 1132 B13R2.1 C=C=Cc1n[nH]c2c1cccc2 271570a_100015277604_100000050141 [0,2,0,0,0,0|2,0,0]=4 1133 B13R2.1 CC=Cc1coc2c1cccc2 271570a_100016259895_100009812202 [0,2,0,0,0,0|2,0,0]=4 1134 B13R2.1 CC=Cc1n[nH]c2c1cccc2 271570a_100016259895_100000050141 [0,2,0,0,0,0|2,0,0]=4 1135 B13R2.1 CCOc1csc2c1cccc2 34a_100000077758_100000210202 [0,2,0,0,0,0|1,1,0]=4 1136 B13R2.1 CCOc1csc2c1cccc2 7a_100000077758_100000210202 [0,2,0,0,0,0|1,1,0]=4 1137 B13R2.1 CCSc1coc2c1cccc2 62a_100000210202_100009812202 [0,2,0,0,0,0|1,1,0]=4 1138 B13R2.1 CCSc1n[nH]c2c1cccc2 62a_100000210202_100000050141 [0,2,0,0,0,0|1,1,0]=4 1139 B13R2.1 CCSc1noc2c1cccc2 62a_100000210202_200000703156 [0,2,0,0,0,0|0,1,0]=3 1140 B13R2.1 CCSc1noc2c1cccc2 62a_200000703156_100000210202 [0,2,0,0,0,0|0,1,0]=3 1141 B13R2.1 CNCc1coc2c1cccc2 207a_100102657272_100000688544 [0,2,0,0,0,0|2,0,0]=4 1142 B13R2.1 CNCc1coc2c1cccc2 270004a_106832991635_100000688544 [0,2,0,0,0,0|2,0,0]=4 1143 B13R2.1 CNCc1n[nH]c2c1cccc2 207a_100102657272_100000059708 [0,2,0,0,0,0|2,0,0]=4 1144 B13R2.1 CNCc1n[nH]c2c1cccc2 270004a_106832991635_100000059708 [0,2,0,0,0,0|2,0,0]=4 1145 B13R2.1 CNCc1noc2c1cccc2 34a_100102657272_100009813815 [0,2,0,0,0,0|1,0,0]=3 1146 B13R2.1 CNCc1noc2c1cccc2 7a_106832991635_100009813815 [0,2,0,0,0,0|1,0,0]=3 1147 B13R2.1 COCc1csc2c1cccc2 34a_100011219454_200000210301 [0,2,0,0,0,0|1,1,0]=4 1148 B13R2.1 COCc1csc2c1cccc2 34a_100138415774_200000742921 [0,2,0,0,0,0|1,1,0]=4 1149 B13R2.1 COCc1noc2c1cccc2 34a_100138415774_100009813815 [0,2,0,0,0,0|0,0,0]=2 1150 B13R2.1 COCn1nnc2c1cccc2 34a_100138415774_100000033166 [0,2,0,0,0,0|2,0,0]=4 1151 B13R2.1 CSCc1noc2c1cccc2 62a_100009813815_200000210301 [0,2,0,0,0,0|0,1,0]=3 1152 B13R2.1 CSCc1noc2c1cccc2 62a_200000210301_100009813815 [0,2,0,0,0,0|0,1,0]=3 1153 B13R2.1 FCOc1csc2c1cccc2 34a_100000077758_100015361967 [0,2,0,0,0,0|1,1,0]=4 1154 B13R2.1 FCOc1csc2c1cccc2 7a_100000077758_100015361967 [0,2,0,0,0,0|1,1,0]=4 1155 B13R2.1 FCSc1coc2c1cccc2 62a_100015361967_100009812202 [0,2,0,0,0,0|1,1,0]=4 1156 B13R2.1 FCSc1n[nH]c2c1cccc2 62a_100015361967_100000050141 [0,2,0,0,0,0|1,1,0]=4 1157 B13R2.1 FCSc1noc2c1cccc2 62a_100015361967_200000703156 [0,2,0,0,0,0|0,1,0]=3 1158 B13R2.1 FCSc1noc2c1cccc2 62a_200000703156_100015361967 [0,2,0,0,0,0|0,1,0]=3 1159 B13R2.1 [13CH3]OCc1csc2c1cccc2 34a_100011219454_200025704644 [0,2,0,0,0,0|1,1,0]=4 1160 B13R2.1 [13CH3]SCc1noc2c1cccc2 62a_100009813815_200025704644 [0,2,0,0,0,0|0,1,0]=3 1161 B13R2.1 [13CH3]SCc1noc2c1cccc2 62a_200025704644_100009813815 [0,2,0,0,0,0|0,1,0]=3 1162 B13R2.9 C=Cc1n[nH]c2c1cccc2Br 271570a_100011290941_100010197283 [0,2,0,0,0,0|2,0,0]=4 1163 B13R2.9 C=Cc1n[nH]c2c1cccc2C 271570a_100011290941_100010186057 [0,2,0,0,0,0|2,0,0]=4 1164 B13R2.9 C=Cc1n[nH]c2c1cccc2Cl 271570a_100011290941_100000050086 [0,2,0,0,0,0|2,0,0]=4 1165 B13R2.9 C=Cc1n[nH]c2c1cccc2F 271570a_100011290941_100010231504 [0,2,0,0,0,0|2,0,0]=4 1166 B13R2.9 C=Cc1n[nH]c2c1cccc2N 271570a_100011290941_100009888981 [0,2,0,0,0,0|2,0,0]=4 1167 B13R2.9 C=Cc1n[nH]c2c1cccc2O 271570a_100011290941_200010988877 [0,2,0,0,0,0|2,0,0]=4 1168 B13R2.9 COc1noc2c1cccc2C 34a_100000041175_200000210301 [0,2,0,0,0,0|0,0,0]=2 1169 B13R2.9 CSc1n[nH]c2c1cccc2Br 62a_200000210301_100010197283 [0,2,0,0,0,0|1,1,0]=4 1170 B13R2.9 CSc1n[nH]c2c1cccc2C 62a_200000210301_100010186057 [0,2,0,0,0,0|1,1,0]=4 1171 B13R2.9 CSc1n[nH]c2c1cccc2Cl 62a_200000210301_100000050086 [0,2,0,0,0,0|1,1,0]=4 1172 B13R2.9 CSc1n[nH]c2c1cccc2F 62a_200000210301_100010231504 [0,2,0,0,0,0|1,1,0]=4 1173 B13R2.9 CSc1n[nH]c2c1cccc2N 62a_200000210301_100009888981 [0,2,0,0,0,0|1,1,0]=4 1174 B13R2.9 CSc1n[nH]c2c1cccc2O 62a_200000210301_200010988877 [0,2,0,0,0,0|1,1,0]=4 1175 B13R2.9 Cc1cccc2c1[nH]nc2S[13CH3] 62a_200025704644_100010186057 [0,2,0,0,0,0|1,1,0]=4 1176 B13R2.9 Cc1cccc2c1onc2O[13CH3] 34a_100000041175_200025704644 [0,2,0,0,0,0|0,0,0]=2 1177 B13R2.9 O=Cc1n[nH]c2c1cccc2O 271570a_203496583355_100009814788 [0,2,0,0,0,0|1,0,1]=4 1178 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2Br 62a_200025704644_100010197283 [0,2,0,0,0,0|1,1,0]=4 1179 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2Cl 62a_200025704644_100000050086 [0,2,0,0,0,0|1,1,0]=4 1180 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2F 62a_200025704644_100010231504 [0,2,0,0,0,0|1,1,0]=4 1181 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2N 62a_200025704644_100009888981 [0,2,0,0,0,0|1,1,0]=4 1182 B13R2.9 [13CH3]Sc1n[nH]c2c1cccc2O 62a_200025704644_200010988877 [0,2,0,0,0,0|1,1,0]=4 1183 B13R2.72 C=C(C)c1coc2c1cccc2 271570a_100000694244_100009812202 [0,2,0,0,0,0|2,0,0]=4 1184 B13R2.72 C=C(C)c1n[nH]c2c1cccc2 271570a_100000694244_100000050141 [0,2,0,0,0,0|2,0,0]=4 1185 B13R2.135 C=Cc1c(oc2c1cccc2)C 271570a_100011290941_200010236113 [0,2,0,0,0,0|2,0,0]=4 1186 B13R2.135 CSc1c(oc2c1cccc2)C 62a_200000210301_200010236113 [0,2,0,0,0,0|1,1,0]=4 1187 B13R2.135 Cc1oc2ccccc2c1S[13CH3] 62a_200025704644_200010236113 [0,2,0,0,0,0|1,1,0]=4 1188 B13R2.662 C=Cc1n[nH]c2c1ccc(c2)Br 271570a_100011290941_100010186045 [0,2,0,0,0,0|2,0,0]=4 1189 B13R2.662 C=Cc1n[nH]c2c1ccc(c2)C 271570a_100011290941_100000049534 [0,2,0,0,0,0|2,0,0]=4 1190 B13R2.662 C=Cc1n[nH]c2c1ccc(c2)Cl 271570a_100011290941_100000049627 [0,2,0,0,0,0|2,0,0]=4 1191 B13R2.662 C=Cc1n[nH]c2c1ccc(c2)F 271570a_100011290941_100000049990 [0,2,0,0,0,0|2,0,0]=4 1192 B13R2.662 C=Cc1n[nH]c2c1ccc(c2)N 271570a_100011290941_100009816878 [0,2,0,0,0,0|2,0,0]=4 1193 B13R2.662 COc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010742842 [0,2,0,0,0,0|1,0,0]=3 1194 B13R2.662 CSc1n[nH]c2c1ccc(c2)Br 62a_100010186045_200000210301 [0,2,0,0,0,0|1,1,0]=4 1195 B13R2.662 CSc1n[nH]c2c1ccc(c2)Br 62a_200000210301_100010186045 [0,2,0,0,0,0|1,1,0]=4 1196 B13R2.662 CSc1n[nH]c2c1ccc(c2)C 62a_200000210301_100000049534 [0,2,0,0,0,0|1,1,0]=4 1197 B13R2.662 CSc1n[nH]c2c1ccc(c2)Cl 62a_200000210301_100000049627 [0,2,0,0,0,0|1,1,0]=4 1198 B13R2.662 CSc1n[nH]c2c1ccc(c2)F 62a_200000210301_100000049990 [0,2,0,0,0,0|1,1,0]=4 1199 B13R2.662 CSc1n[nH]c2c1ccc(c2)N 62a_200000210301_100009816878 [0,2,0,0,0,0|1,1,0]=4 1200 B13R2.662 Cc1ccc2c(n[nH]c2c1)S[13CH3] 62a_200025704644_100000049534 [0,2,0,0,0,0|1,1,0]=4 1201 B13R2.662 N#Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010171363 [0,2,0,0,0,0|2,0,0]=4 1202 B13R2.662 O=Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009817233 [0,2,0,0,0,0|1,0,1]=4 1203 B13R2.662 OCc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100010177469 [0,2,0,0,0,0|1,0,0]=3 1204 B13R2.662 [13CH3]Sc1n[nH]c2c1ccc(c2)Br 62a_100010186045_200025704644 [0,2,0,0,0,0|1,1,0]=4 1205 B13R2.662 [13CH3]Sc1n[nH]c2c1ccc(c2)Br 62a_200025704644_100010186045 [0,2,0,0,0,0|1,1,0]=4 1206 B13R2.662 [13CH3]Sc1n[nH]c2c1ccc(c2)Cl 62a_200025704644_100000049627 [0,2,0,0,0,0|1,1,0]=4 1207 B13R2.662 [13CH3]Sc1n[nH]c2c1ccc(c2)F 62a_200025704644_100000049990 [0,2,0,0,0,0|1,1,0]=4 1208 B13R2.662 [13CH3]Sc1n[nH]c2c1ccc(c2)N 62a_200025704644_100009816878 [0,2,0,0,0,0|1,1,0]=4 1209 B13R2.2091 C=Cc1n[nH]c2c1c(ccc2)Br 271570a_100011290941_100010186043 [0,2,0,0,0,0|2,0,0]=4 1210 B13R2.2091 C=Cc1n[nH]c2c1c(ccc2)C 271570a_100011290941_100000049903 [0,2,0,0,0,0|2,0,0]=4 1211 B13R2.2091 C=Cc1n[nH]c2c1c(ccc2)Cl 271570a_100011290941_100000049730 [0,2,0,0,0,0|2,0,0]=4 1212 B13R2.2091 C=Cc1n[nH]c2c1c(ccc2)F 271570a_100011290941_100000049989 [0,2,0,0,0,0|2,0,0]=4 1213 B13R2.2091 C=Cc1n[nH]c2c1c(ccc2)N 271570a_100011290941_100010186038 [0,2,0,0,0,0|2,0,0]=4 1214 B13R2.2091 COc1noc2c1c(ccc2)F 34a_100009888067_200000210301 [0,2,0,0,0,0|0,0,0]=2 1215 B13R2.2091 CSc1n[nH]c2c1c(ccc2)Br 62a_200000210301_100010186043 [0,2,0,0,0,0|1,1,0]=4 1216 B13R2.2091 CSc1n[nH]c2c1c(ccc2)C 62a_200000210301_100000049903 [0,2,0,0,0,0|1,1,0]=4 1217 B13R2.2091 CSc1n[nH]c2c1c(ccc2)Cl 62a_200000210301_100000049730 [0,2,0,0,0,0|1,1,0]=4 1218 B13R2.2091 CSc1n[nH]c2c1c(ccc2)F 62a_200000210301_100000049989 [0,2,0,0,0,0|1,1,0]=4 1219 B13R2.2091 CSc1n[nH]c2c1c(ccc2)N 62a_200000210301_100010186038 [0,2,0,0,0,0|1,1,0]=4 1220 B13R2.2091 Cc1cccc2c1c(n[nH]2)S[13CH3] 62a_200025704644_100000049903 [0,2,0,0,0,0|1,1,0]=4 1221 B13R2.2091 N#Cc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100010244415 [0,2,0,0,0,0|2,0,0]=4 1222 B13R2.2091 [13CH3]Oc1noc2c1c(ccc2)F 34a_100009888067_200025704644 [0,2,0,0,0,0|0,0,0]=2 1223 B13R2.2091 [13CH3]Sc1n[nH]c2c1c(ccc2)Br 62a_200025704644_100010186043 [0,2,0,0,0,0|1,1,0]=4 1224 B13R2.2091 [13CH3]Sc1n[nH]c2c1c(ccc2)Cl 62a_200025704644_100000049730 [0,2,0,0,0,0|1,1,0]=4 1225 B13R2.2091 [13CH3]Sc1n[nH]c2c1c(ccc2)F 62a_200025704644_100000049989 [0,2,0,0,0,0|1,1,0]=4 1226 B13R2.2091 [13CH3]Sc1n[nH]c2c1c(ccc2)N 62a_200025704644_100010186038 [0,2,0,0,0,0|1,1,0]=4 1227 B13R2.2136 C=Cc1n[nH]c2c1cc(cc2)Br 271570a_100011290941_100010186058 [0,2,0,0,0,0|2,0,0]=4 1228 B13R2.2136 C=Cc1n[nH]c2c1cc(cc2)C 271570a_100011290941_100000123028 [0,2,0,0,0,0|2,0,0]=4 1229 B13R2.2136 C=Cc1n[nH]c2c1cc(cc2)Cl 271570a_100011290941_100010174404 [0,2,0,0,0,0|2,0,0]=4 1230 B13R2.2136 C=Cc1n[nH]c2c1cc(cc2)F 271570a_100011290941_100011934747 [0,2,0,0,0,0|2,0,0]=4 1231 B13R2.2136 C=Cc1n[nH]c2c1cc(cc2)N 271570a_100011290941_100012353729 [0,2,0,0,0,0|2,0,0]=4 1232 B13R2.2136 COc1n[nH]c2c1cc(cn2)O 271570a_203496583355_200010724658 [0,2,0,0,0,0|2,0,0]=4 1233 B13R2.2136 CSc1n[nH]c2c1cc(cc2)Br 62a_200000210301_100010186058 [0,2,0,0,0,0|1,1,0]=4 1234 B13R2.2136 CSc1n[nH]c2c1cc(cc2)C 62a_200000210301_100000123028 [0,2,0,0,0,0|1,1,0]=4 1235 B13R2.2136 CSc1n[nH]c2c1cc(cc2)Cl 62a_200000210301_100010174404 [0,2,0,0,0,0|1,1,0]=4 1236 B13R2.2136 CSc1n[nH]c2c1cc(cc2)F 62a_200000210301_100011934747 [0,2,0,0,0,0|1,1,0]=4 1237 B13R2.2136 CSc1n[nH]c2c1cc(cc2)N 62a_200000210301_100012353729 [0,2,0,0,0,0|1,1,0]=4 1238 B13R2.2136 Cc1ccc2[nH]nc(c2c1)S[13CH3] 62a_200025704644_100000123028 [0,2,0,0,0,0|1,1,0]=4 1239 B13R2.2136 N#Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100010178026 [0,2,0,0,0,0|2,0,0]=4 1240 B13R2.2136 O=Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100009888965 [0,2,0,0,0,0|1,0,1]=4 1241 B13R2.2136 [13CH3]Sc1n[nH]c2c1cc(cc2)Br 62a_200025704644_100010186058 [0,2,0,0,0,0|1,1,0]=4 1242 B13R2.2136 [13CH3]Sc1n[nH]c2c1cc(cc2)Cl 62a_200025704644_100010174404 [0,2,0,0,0,0|1,1,0]=4 1243 B13R2.2136 [13CH3]Sc1n[nH]c2c1cc(cc2)F 62a_200025704644_100011934747 [0,2,0,0,0,0|1,1,0]=4 1244 B13R2.2136 [13CH3]Sc1n[nH]c2c1cc(cc2)N 62a_200025704644_100012353729 [0,2,0,0,0,0|1,1,0]=4 1245 B13R2.2931 C=Cc1nn(c2c1cccc2)C 271570a_100011290941_100009817141 [0,2,0,0,0,0|2,0,0]=4 1246 B13R2.2931 CCn1nc(c2c1cccc2)O 271570a_203496583355_200010288290 [0,2,0,0,0,0|1,0,0]=3 1247 B13R2.2931 CSc1nn(c2c1cccc2)C 62a_100009817141_200000210301 [0,2,0,0,0,0|1,1,0]=4 1248 B13R2.2931 CSc1nn(c2c1cccc2)C 62a_200000210301_100009817141 [0,2,0,0,0,0|1,1,0]=4 1249 B13R2.2931 Cn1nc(c2c1cccc2)S[13CH3] 62a_100009817141_200025704644 [0,2,0,0,0,0|1,1,0]=4 1250 B13R2.2931 Cn1nc(c2c1cccc2)S[13CH3] 62a_200025704644_100009817141 [0,2,0,0,0,0|1,1,0]=4 1251 B13R2.45 O=Cc1sc2ccccc2c1O 271570a_203496583355_100009816528 [0,2,0,0,0,0|1,1,0]=4 1252 B13R2.669 C=Cc1ccc2[nH]nc(c2c1)Br 271570a_100011290941_200012353728 [0,2,0,0,0,0|2,0,0]=4 1253 B13R2.669 C=Cc1ccc2[nH]nc(c2c1)C 271570a_100011290941_100102524909 [0,2,0,0,0,0|2,0,0]=4 1254 B13R2.669 C=Cc1ccc2[nH]nc(c2c1)N 271570a_100011290941_100011934329 [0,2,0,0,0,0|2,0,0]=4 1255 B13R2.669 C=Cc1ccc2c(c1)C(=O)CO2 271570a_100011290941_100000752586 [0,2,0,0,0,0|1,0,1]=4 1256 B13R2.669 C=Cc1ccc2o[nH]c(=O)c2c1 271570a_100011290941_100000732257 [0,2,0,0,0,0|0,0,2]=4 1257 B13R2.669 C=Cc1ccc2occ(c2c1)C 271570a_100011290941_100000728893 [0,2,0,0,0,0|2,0,0]=4 1258 B13R2.669 C=Cc1ccc2onc(c2c1)C 271570a_100011290941_100010196875 [0,2,0,0,0,0|1,0,0]=3 1259 B13R2.669 C=Cc1ccc2onc(c2c1)N 271570a_100011290941_100012356444 [0,2,0,0,0,0|1,0,0]=3 1260 B13R2.669 C=Cc1ccc2snc(c2c1)N 271570a_100011290941_100010244976 [0,2,0,0,0,0|1,1,0]=4 1261 B13R2.669 CNc1ccc2onc(c2c1)C 34a_200000044492_200000210301 [0,2,0,0,0,0|1,0,0]=3 1262 B13R2.669 COc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353730 [0,2,0,0,0,0|1,0,0]=3 1263 B13R2.669 COc1ccc2[nH]nc(c2n1)O 271570a_203496583355_200010246295 [0,2,0,0,0,0|2,0,0]=4 1264 B13R2.669 CSc1ccc2[nH]nc(c2c1)Br 62a_200000210301_200012353728 [0,2,0,0,0,0|2,0,0]=4 1265 B13R2.669 CSc1ccc2[nH]nc(c2c1)Br 62a_200012353728_200000210301 [0,2,0,0,0,0|2,0,0]=4 1266 B13R2.669 CSc1ccc2[nH]nc(c2c1)C 62a_200000210301_100102524909 [0,2,0,0,0,0|2,0,0]=4 1267 B13R2.669 CSc1ccc2c(c1)C(=O)CO2 62a_200000210301_100000752586 [0,2,0,0,0,0|1,0,1]=4 1268 B13R2.669 CSc1ccc2o[nH]c(=O)c2c1 62a_200000210301_100000732257 [0,2,0,0,0,0|0,0,2]=4 1269 B13R2.669 CSc1ccc2occ(c2c1)C 62a_200000210301_100000728893 [0,2,0,0,0,0|2,0,0]=4 1270 B13R2.669 CSc1ccc2onc(c2c1)C 62a_100010196875_200000210301 [0,2,0,0,0,0|1,0,0]=3 1271 B13R2.669 CSc1ccc2onc(c2c1)C 62a_200000210301_100010196875 [0,2,0,0,0,0|1,0,0]=3 1272 B13R2.669 CSc1ccc2onc(c2c1)N 62a_100012356444_200000210301 [0,2,0,0,0,0|1,0,0]=3 1273 B13R2.669 CSc1ccc2onc(c2c1)N 62a_200000210301_100012356444 [0,2,0,0,0,0|1,0,0]=3 1274 B13R2.669 CSc1ccc2snc(c2c1)N 62a_100010244976_200000210301 [0,2,0,0,0,0|1,1,0]=4 1275 B13R2.669 Cc1coc2c1cc(cc2)S[13CH3] 62a_200025704644_100000728893 [0,2,0,0,0,0|2,0,0]=4 1276 B13R2.669 Cc1n[nH]c2c1cc(cc2)S[13CH3] 62a_200025704644_100102524909 [0,2,0,0,0,0|2,0,0]=4 1277 B13R2.669 Cc1noc2c1cc(cc2)N[13CH3] 34a_200000044492_200025704644 [0,2,0,0,0,0|1,0,0]=3 1278 B13R2.669 Cc1noc2c1cc(cc2)S[13CH3] 62a_100010196875_200025704644 [0,2,0,0,0,0|1,0,0]=3 1279 B13R2.669 Cc1noc2c1cc(cc2)S[13CH3] 62a_200025704644_100010196875 [0,2,0,0,0,0|1,0,0]=3 1280 B13R2.669 N#Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_200009888970 [0,2,0,0,0,0|1,0,0]=3 1281 B13R2.669 N#Cc1cnc2[nH]nc(c2c1)O 271570a_203496583355_100010745169 [0,2,0,0,0,0|2,0,0]=4 1282 B13R2.669 O=Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100009817145 [0,2,0,0,0,0|1,0,0]=3 1283 B13R2.669 [13CH3]Sc1ccc2[nH]nc(c2c1)Br 62a_200012353728_200025704644 [0,2,0,0,0,0|2,0,0]=4 1284 B13R2.669 [13CH3]Sc1ccc2[nH]nc(c2c1)Br 62a_200025704644_200012353728 [0,2,0,0,0,0|2,0,0]=4 1285 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CO2 62a_200025704644_100000752586 [0,2,0,0,0,0|1,0,1]=4 1286 B13R2.669 [13CH3]Sc1ccc2o[nH]c(=O)c2c1 62a_200025704644_100000732257 [0,2,0,0,0,0|0,0,2]=4 1287 B13R2.669 [13CH3]Sc1ccc2onc(c2c1)N 62a_100012356444_200025704644 [0,2,0,0,0,0|1,0,0]=3 1288 B13R2.669 [13CH3]Sc1ccc2onc(c2c1)N 62a_200025704644_100012356444 [0,2,0,0,0,0|1,0,0]=3 1289 B13R2.669 [13CH3]Sc1ccc2snc(c2c1)N 62a_100010244976_200025704644 [0,2,0,0,0,0|1,1,0]=4 1290 B13R2.3742 Cc1n[nH]c2c1cc(cc2C)O 271570a_203496583355_100102525159 [0,2,0,0,0,0|2,0,0]=4 1291 B13R2.3790 Oc1n[nH]c2c1c(c(cc2)Br)F 271570a_203496583355_200010232220 [0,2,0,0,0,0|1,0,0]=3 1292 B13R2.5187 Cc1ccc2c(c1)c(nn2C)O 271570a_203496583355_100000123007 [0,2,0,0,0,0|1,0,0]=3 1293 B13R2.5187 Cc1ccc2c(nn(c2c1)C)O 271570a_203496583355_100010073239 [0,2,0,0,0,0|1,0,0]=3 1294 B13R2.5187 Cc1nn(c2c1cc(cc2)O)C 271570a_203496583355_100010255089 [0,2,0,0,0,0|2,0,0]=4 1295 B13R2.5187 Cc1nn(c2c1ccc(c2)O)C 271570a_203496583355_100010255092 [0,2,0,0,0,0|2,0,0]=4 1296 B13R2.5187 Cn1nc(c2c1cc(cc2)Br)O 271570a_203496583355_100010161269 [0,2,0,0,0,0|1,0,0]=3 1297 B13R2.5187 Cn1nc(c2c1cc(cc2)F)O 271570a_203496583355_100010161261 [0,2,0,0,0,0|1,0,0]=3 1298 B13R2.5187 Cn1nc(c2c1cc(cc2)N)O 271570a_203496583355_100010163569 [0,2,0,0,0,0|1,0,0]=3 1299 B13R2.5187 Cn1nc(c2c1cc(cc2)O)N 271570a_203496583355_100010244983 [0,2,0,0,0,0|2,0,0]=4 1300 B13R2.5187 Cn1nc(c2c1ccc(c2)Br)O 271570a_203496583355_100010161270 [0,2,0,0,0,0|1,0,0]=3 1301 B13R2.5187 Cn1nc(c2c1ccc(c2)F)O 271570a_203496583355_200000123018 [0,2,0,0,0,0|1,0,0]=3 1302 B13R2.5187 Cn1nc(c2c1ccc(c2)N)O 271570a_203496583355_100010234897 [0,2,0,0,0,0|1,0,0]=3 1303 B13R2.5187 Cn1nc(c2c1ccc(c2)O)N 271570a_203496583355_100010240166 [0,2,0,0,0,0|2,0,0]=4 1304 B13R2.5187 Cn1nc(c2c1ccc(c2)O)O 271570a_203496583355_100015481540 [0,2,0,0,0,0|1,0,0]=3 1305 B13R2.11634 Cc1cc2[nH]nc(c2cc1Br)O 271570a_203496583355_200015481476 [0,2,0,0,0,0|1,0,0]=3 1306 B13R2.11634 Cc1cc2[nH]nc(c2cc1N)O 271570a_203496583355_100010199655 [0,2,0,0,0,0|1,0,0]=3 1307 B13R2.11634 Cc1n[nH]c2c1cc(c(c2)O)F 271570a_203496583355_100010264033 [0,2,0,0,0,0|2,0,0]=4 1308 B13R2.11634 Oc1n[nH]c2c1cc(c(c2)Br)F 271570a_203496583355_100010144800 [0,2,0,0,0,0|1,0,0]=3 1309 B13R2.11634 Oc1n[nH]c2c1cc(c(c2)Cl)Br 271570a_203496583355_100025705592 [0,2,0,0,0,0|1,0,0]=3 1310 B13R2.11634 Oc1n[nH]c2c1cc(c(c2)Cl)Cl 271570a_203496583355_100010977401 [0,2,0,0,0,0|1,0,0]=3 1311 B13R2.11634 Oc1n[nH]c2c1cc(c(c2)F)Br 271570a_203496583355_100010170943 [0,2,0,0,0,0|1,0,0]=3 1312 B13R2.573 C=Cc1cccc2c1OCC2=O 271570a_100011290941_100011230590 [0,2,0,0,0,0|1,0,1]=4 1313 B13R2.573 C=Cc1cccc2c1[nH]nc2C 271570a_100011290941_100010255084 [0,2,0,0,0,0|2,0,0]=4 1314 B13R2.573 C=Cc1cccc2c1[nH]nc2N 271570a_100011290941_100010069757 [0,2,0,0,0,0|2,0,0]=4 1315 B13R2.573 C=Cc1cccc2c1onc2N 271570a_100011290941_100010069758 [0,2,0,0,0,0|1,0,0]=3 1316 B13R2.573 COc1cccc2c1[nH]nc2O 271570a_203496583355_100010231496 [0,2,0,0,0,0|1,0,0]=3 1317 B13R2.573 CSc1cccc2c1OCC2=O 62a_200000210301_100011230590 [0,2,0,0,0,0|1,0,1]=4 1318 B13R2.573 CSc1cccc2c1[nH]nc2C 62a_200000210301_100010255084 [0,2,0,0,0,0|2,0,0]=4 1319 B13R2.573 CSc1cccc2c1onc2N 62a_100010069758_200000210301 [0,2,0,0,0,0|1,0,0]=3 1320 B13R2.573 CSc1cccc2c1onc2N 62a_200000210301_100010069758 [0,2,0,0,0,0|1,0,0]=3 1321 B13R2.573 Cc1n[nH]c2c1cccc2S[13CH3] 62a_200025704644_100010255084 [0,2,0,0,0,0|2,0,0]=4 1322 B13R2.573 N#Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010245458 [0,2,0,0,0,0|1,0,0]=3 1323 B13R2.573 [13CH3]Sc1cccc2c1OCC2=O 62a_200025704644_100011230590 [0,2,0,0,0,0|1,0,1]=4 1324 B13R2.573 [13CH3]Sc1cccc2c1onc2N 62a_100010069758_200025704644 [0,2,0,0,0,0|1,0,0]=3 1325 B13R2.573 [13CH3]Sc1cccc2c1onc2N 62a_200025704644_100010069758 [0,2,0,0,0,0|1,0,0]=3 1326 B13R2.4857 Cc1cccc2c1c(nn2C)O 271570a_203496583355_100000123023 [0,2,0,0,0,0|1,0,0]=3 1327 B13R2.4857 Cn1nc(c2c1cccc2F)O 271570a_203496583355_200010161262 [0,2,0,0,0,0|1,0,0]=3 1328 B13R2.4857 Cn1nc(c2c1cccc2N)O 271570a_203496583355_100010235561 [0,2,0,0,0,0|1,0,0]=3 1329 B13R2.4857 Cn1nc(c2c1cccc2O)N 271570a_203496583355_100010211377 [0,2,0,0,0,0|2,0,0]=4 1330 B13R2.5151 Nc1n[nH]c2c1c(ccc2F)O 271570a_203496583355_200010174369 [0,2,0,0,0,0|2,0,0]=4 1331 B13R2.582 C=Cc1cccc2c1C(=O)CO2 271570a_100011290941_100010205902 [0,2,0,0,0,0|1,0,1]=4 1332 B13R2.582 C=Cc1cccc2c1c(n[nH]2)C 271570a_100011290941_100010205804 [0,2,0,0,0,0|2,0,0]=4 1333 B13R2.582 C=Cc1cccc2c1c(n[nH]2)N 271570a_100011290941_100000049960 [0,2,0,0,0,0|2,0,0]=4 1334 B13R2.582 C=Cc1cccc2c1c(no2)N 271570a_100011290941_100012361266 [0,2,0,0,0,0|1,0,0]=3 1335 B13R2.582 COc1cccc2c1C(=O)CO2 34a_200009856558_200000210301 [0,2,0,0,0,0|1,0,1]=4 1336 B13R2.582 COc1cccc2c1c(n[nH]2)O 271570a_203496583355_100010231497 [0,2,0,0,0,0|1,0,0]=3 1337 B13R2.582 CSc1cccc2c1C(=O)CO2 62a_200000210301_100010205902 [0,2,0,0,0,0|1,0,1]=4 1338 B13R2.582 CSc1cccc2c1c(n[nH]2)C 62a_200000210301_100010205804 [0,2,0,0,0,0|2,0,0]=4 1339 B13R2.582 CSc1cccc2c1c(no2)N 62a_100012361266_200000210301 [0,2,0,0,0,0|1,0,0]=3 1340 B13R2.582 CSc1cccc2c1c(no2)N 62a_200000210301_100012361266 [0,2,0,0,0,0|1,0,0]=3 1341 B13R2.582 Cc1n[nH]c2c1c(ccc2)S[13CH3] 62a_200025704644_100010205804 [0,2,0,0,0,0|2,0,0]=4 1342 B13R2.582 N#Cc1cccc2c1c(c[nH]2)O 271570a_203496583355_100012350721 [0,2,0,0,0,0|2,0,0]=4 1343 B13R2.582 N#Cc1cccc2c1c(n[nH]2)O 271570a_203496583355_100010204399 [0,2,0,0,0,0|1,0,0]=3 1344 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CO2 34a_200009856558_200025704644 [0,2,0,0,0,0|1,0,1]=4 1345 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CO2 62a_200025704644_100010205902 [0,2,0,0,0,0|1,0,1]=4 1346 B13R2.582 [13CH3]Sc1cccc2c1c(no2)N 62a_100012361266_200025704644 [0,2,0,0,0,0|1,0,0]=3 1347 B13R2.582 [13CH3]Sc1cccc2c1c(no2)N 62a_200025704644_100012361266 [0,2,0,0,0,0|1,0,0]=3 1348 B13R2.11642 Cc1cc(c2c(nsc2n1)O)C 271570a_203496583355_200009998358 [0,2,0,0,0,0|1,1,0]=4 1349 B13R2.11642 Nc1n[nH]c2c1c(cc(c2)O)F 271570a_203496583355_100010779177 [0,2,0,0,0,0|2,0,0]=4 1350 B13R2.11642 Oc1n[nH]c2c1c(cc(c2)Br)Cl 271570a_203496583355_100010186188 [0,2,0,0,0,0|1,0,0]=3 1351 B13R2.11642 Oc1n[nH]c2c1c(cc(c2)Cl)Cl 271570a_203496583355_200010186120 [0,2,0,0,0,0|1,0,0]=3 1352 B13R2.11642 Oc1n[nH]c2c1c(cc(c2)Cl)F 271570a_203496583355_100000049905 [0,2,0,0,0,0|1,0,0]=3 1353 B13R2.2130 C=Cc1ccc2c(c1)OCC2=O 271570a_100011290941_100000686717 [0,2,0,0,0,0|1,0,1]=4 1354 B13R2.2130 C=Cc1ccc2c(coc2c1)C 271570a_100011290941_100010775837 [0,2,0,0,0,0|2,0,0]=4 1355 B13R2.2130 C=Cc1ccc2c(n[nH]c2c1)C 271570a_100011290941_100009816850 [0,2,0,0,0,0|2,0,0]=4 1356 B13R2.2130 C=Cc1ccc2c(n[nH]c2c1)N 271570a_100011290941_100011934401 [0,2,0,0,0,0|2,0,0]=4 1357 B13R2.2130 C=Cc1ccc2c(noc2c1)C 271570a_100011290941_100009815287 [0,2,0,0,0,0|1,0,0]=3 1358 B13R2.2130 C=Cc1ccc2c(noc2c1)N 271570a_100011290941_100012356334 [0,2,0,0,0,0|1,0,0]=3 1359 B13R2.2130 C=Cc1ccc2c(noc2c1)O 271570a_100011290941_100000727085 [0,2,0,0,0,0|0,0,0]=2 1360 B13R2.2130 COc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049672 [0,2,0,0,0,0|1,0,0]=3 1361 B13R2.2130 COc1ccc2c(noc2c1)C 34a_200000076027_200000210301 [0,2,0,0,0,0|1,0,0]=3 1362 B13R2.2130 CSc1ccc2c(c1)OCC2=O 62a_200000210301_100000686717 [0,2,0,0,0,0|1,0,1]=4 1363 B13R2.2130 CSc1ccc2c(coc2c1)C 62a_200000210301_100010775837 [0,2,0,0,0,0|2,0,0]=4 1364 B13R2.2130 CSc1ccc2c(n[nH]c2c1)C 62a_200000210301_100009816850 [0,2,0,0,0,0|2,0,0]=4 1365 B13R2.2130 CSc1ccc2c(noc2c1)C 62a_100009815287_200000210301 [0,2,0,0,0,0|1,0,0]=3 1366 B13R2.2130 CSc1ccc2c(noc2c1)C 62a_200000210301_100009815287 [0,2,0,0,0,0|1,0,0]=3 1367 B13R2.2130 CSc1ccc2c(noc2c1)N 62a_100012356334_200000210301 [0,2,0,0,0,0|1,0,0]=3 1368 B13R2.2130 CSc1ccc2c(noc2c1)N 62a_200000210301_100012356334 [0,2,0,0,0,0|1,0,0]=3 1369 B13R2.2130 Cc1coc2c1ccc(c2)S[13CH3] 62a_200025704644_100010775837 [0,2,0,0,0,0|2,0,0]=4 1370 B13R2.2130 Cc1n[nH]c2c1ccc(c2)S[13CH3] 62a_200025704644_100009816850 [0,2,0,0,0,0|2,0,0]=4 1371 B13R2.2130 Cc1noc2c1ccc(c2)O[13CH3] 34a_200000076027_200025704644 [0,2,0,0,0,0|1,0,0]=3 1372 B13R2.2130 Cc1noc2c1ccc(c2)S[13CH3] 62a_100009815287_200025704644 [0,2,0,0,0,0|1,0,0]=3 1373 B13R2.2130 Cc1noc2c1ccc(c2)S[13CH3] 62a_200025704644_100009815287 [0,2,0,0,0,0|1,0,0]=3 1374 B13R2.2130 N#Cc1ccc2c(c[nH]c2c1)O 271570a_203496583355_200014310816 [0,2,0,0,0,0|2,0,0]=4 1375 B13R2.2130 N#Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100010232206 [0,2,0,0,0,0|1,0,0]=3 1376 B13R2.2130 O=Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100010231508 [0,2,0,0,0,0|1,0,0]=3 1377 B13R2.2130 [13CH3]Sc1ccc2c(c1)OCC2=O 62a_200025704644_100000686717 [0,2,0,0,0,0|1,0,1]=4 1378 B13R2.2130 [13CH3]Sc1ccc2c(noc2c1)N 62a_100012356334_200025704644 [0,2,0,0,0,0|1,0,0]=3 1379 B13R2.2130 [13CH3]Sc1ccc2c(noc2c1)N 62a_200025704644_100012356334 [0,2,0,0,0,0|1,0,0]=3 1380 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,0,1,0,0,1|2,0,0]=4 1381 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,0,1,0,0,1|1,0,1]=4 1382 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,0,1,0,0,1|1,0,1]=4 1383 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,0,1,0,0,1|1,0,1]=4 1384 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,0,1,0,0,1|1,0,1]=4 1385 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,0,1,0,0,1|1,0,1]=4 1386 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,0,1,0,0,1|1,0,1]=4 1387 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,0,1,0,0,1|0,0,2]=4 1388 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,0,1,0,0,1|0,0,2]=4 1389 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,0,1,0,0,1|1,0,1]=4 1390 B11R1.280 C=Cc1cc(cnc1O)C=O 271570a_100011290941_100010064886 [0,0,1,0,0,1|2,0,0]=4