0 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [0,0,0,0,0,0|3,0,1]=4 1 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [0,0,0,0,0,0|3,0,1]=4 2 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [0,0,0,0,0,0|3,0,1]=4 3 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [0,0,0,0,0,0|3,0,1]=4 4 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [0,0,0,0,0,0|3,0,1]=4 6 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [0,0,0,0,0,0|2,0,1]=3 7 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [0,0,0,0,0,0|3,0,1]=4 8 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [0,0,0,0,0,0|2,0,1]=3 9 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [0,0,0,0,0,0|3,0,1]=4 10 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [0,0,0,0,0,0|3,0,1]=4 11 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [0,0,0,0,0,0|3,0,1]=4 12 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [0,0,0,0,0,0|3,0,1]=4 13 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [0,0,0,0,0,0|2,0,1]=3 14 B11R2.1 Oc1n[nH]c2c1cccn2 271570a_203496583355_100009888962 [0,0,0,0,0,0|3,0,1]=4 15 B11R2.1 Oc1n[nH]c2c1ccnc2 271570a_203496583355_100010244369 [0,0,0,0,0,0|3,0,1]=4 16 B11R2.1 Oc1n[nH]c2c1cncc2 271570a_203496583355_100010724670 [0,0,0,0,0,0|3,0,1]=4 17 B11R2.1 Oc1n[nH]c2c1nccc2 271570a_203496583355_100009817118 [0,0,0,0,0,0|3,0,1]=4 18 B11R2.1 Oc1ncn2c1cccc2 271570a_203496583355_100000688344 [0,0,0,0,0,0|2,0,2]=4 19 B11R2.1 Oc1nnc2n1cccc2 271570a_203496583355_100000699609 [0,0,0,0,0,0|3,0,1]=4 20 B12R2.1 C=Cc1coc2c1cccc2 271570a_100011290941_100009812202 [0,1,0,0,0,0|3,0,0]=4 21 B12R2.1 C=Cc1csc2c1cccc2 271570a_100011290941_100009813928 [0,1,0,0,0,0|3,0,0]=4 22 B12R2.1 C=Cc1n[nH]c2c1cccc2 271570a_100011290941_100000050141 [0,1,0,0,0,0|3,0,0]=4 23 B12R2.1 CNC1CCc2c1cccc2 2230a_106832991635_200000721974 [0,1,0,0,0,0|2,0,1]=4 24 B12R2.1 CNC1CCc2c1cccc2 269862a_106832991636_100000212051 [0,1,0,0,0,0|2,0,1]=4 25 B12R2.1 CN[C@H]1CCc2c1cccc2 2230a_100016989578_200000210301 [0,1,0,0,0,0|2,0,1]=4 26 B12R2.1 CN[C@H]1CCc2c1cccc2 34a_100016989578_200000210301 [0,1,0,0,0,0|2,0,1]=4 27 B12R2.1 COC1CCc2c1cccc2 34a_100000212247_200000210301 [0,1,0,0,0,0|1,0,2]=4 28 B12R2.1 COC1CCc2c1cccc2 7a_100000212247_200000210301 [0,1,0,0,0,0|1,0,2]=4 29 B12R2.1 COc1csc2c1cccc2 34a_100000077758_200000210301 [0,1,0,0,0,0|2,0,1]=4 30 B12R2.1 COc1csc2c1cccc2 7a_100000077758_200000210301 [0,1,0,0,0,0|2,0,1]=4 31 B12R2.1 CSC1CCc2c1cccc2 62a_200000210301_200000721974 [0,1,0,0,0,0|1,1,1]=4 32 B12R2.1 CSc1coc2c1cccc2 62a_200000210301_100009812202 [0,1,0,0,0,0|2,1,0]=4 33 B12R2.1 CSc1csc2c1cccc2 62a_200000210301_100009813928 [0,1,0,0,0,0|2,1,0]=4 34 B12R2.1 CSc1n[nH]c2c1cccc2 62a_200000210301_100000050141 [0,1,0,0,0,0|2,1,0]=4 35 B12R2.1 CSc1noc2c1cccc2 62a_200000210301_200000703156 [0,1,0,0,0,0|2,1,0]=4 36 B12R2.1 CSc1noc2c1cccc2 62a_200000703156_200000210301 [0,1,0,0,0,0|2,1,0]=4 37 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 2230a_100016989578_200025704644 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.1 [13CH3]N[C@H]1CCc2c1cccc2 34a_100016989578_200025704644 [0,1,0,0,0,0|2,0,1]=4 39 B12R2.1 [13CH3]OC1CCc2c1cccc2 34a_100000212247_200025704644 [0,1,0,0,0,0|1,0,2]=4 40 B12R2.1 [13CH3]OC1CCc2c1cccc2 7a_100000212247_200025704644 [0,1,0,0,0,0|1,0,2]=4 41 B12R2.1 [13CH3]Oc1csc2c1cccc2 34a_100000077758_200025704644 [0,1,0,0,0,0|2,0,1]=4 42 B12R2.1 [13CH3]Oc1csc2c1cccc2 7a_100000077758_200025704644 [0,1,0,0,0,0|2,0,1]=4 43 B12R2.1 [13CH3]SC1CCc2c1cccc2 62a_200025704644_200000721974 [0,1,0,0,0,0|1,1,1]=4 44 B12R2.1 [13CH3]Sc1coc2c1cccc2 62a_200025704644_100009812202 [0,1,0,0,0,0|2,1,0]=4 45 B12R2.1 [13CH3]Sc1csc2c1cccc2 62a_200025704644_100009813928 [0,1,0,0,0,0|2,1,0]=4 46 B12R2.1 [13CH3]Sc1n[nH]c2c1cccc2 62a_200025704644_100000050141 [0,1,0,0,0,0|2,1,0]=4 47 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200000703156_200025704644 [0,1,0,0,0,0|2,1,0]=4 48 B12R2.1 [13CH3]Sc1noc2c1cccc2 62a_200025704644_200000703156 [0,1,0,0,0,0|2,1,0]=4 49 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,0,0|3,0,0]=4 50 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,0,0|2,0,1]=4 51 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,0,0|2,0,1]=4 52 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,1,0,0,0,0|2,0,1]=4 53 B12R2.132 Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100009816687 [0,1,0,0,0,0|3,0,0]=4 54 B12R2.132 Cc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100000123028 [0,1,0,0,0,0|2,0,1]=4 55 B12R2.132 Cc1coc2c1cc(cc2)O 271570a_203496583355_100000728893 [0,1,0,0,0,0|3,0,0]=4 56 B12R2.132 Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814196 [0,1,0,0,0,0|3,0,0]=4 57 B12R2.132 Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100102524909 [0,1,0,0,0,0|3,0,0]=4 58 B12R2.132 Cc1noc2c1cc(cc2)O 271570a_203496583355_100010196875 [0,1,0,0,0,0|3,0,0]=4 59 B12R2.132 NC1CCc2c1cc(cc2)O 271570a_203496583355_100011435097 [0,1,0,0,0,0|2,0,1]=4 60 B12R2.132 Nc1ccc2[nH]nc(c2c1)O 271570a_203496583355_100012353729 [0,1,0,0,0,0|2,0,1]=4 61 B12R2.132 Nc1ccc2scc(c2c1)O 271570a_203496583355_100011178648 [0,1,0,0,0,0|2,0,1]=4 62 B12R2.132 Nc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100011934329 [0,1,0,0,0,0|3,0,0]=4 63 B12R2.132 Nc1noc2c1cc(cc2)O 271570a_203496583355_100012356444 [0,1,0,0,0,0|3,0,0]=4 64 B12R2.132 Nc1nsc2c1cc(cc2)O 271570a_203496583355_100010244976 [0,1,0,0,0,0|3,0,0]=4 65 B12R2.132 O=C1CCc2c1cc(cc2)O 271570a_203496583355_100000759401 [0,1,0,0,0,0|1,0,0]=2 66 B12R2.132 O=C1CCc2c1cc(cn2)O 271570a_203496583355_100010174022 [0,1,0,0,0,0|2,0,0]=3 67 B12R2.132 O=C1CCc2c1nc(cc2)O 271570a_203496583355_100000701527 [0,1,0,0,0,0|2,0,0]=3 68 B12R2.132 O=C1COc2c1cc(cc2)O 271570a_203496583355_100000752586 [0,1,0,0,0,0|2,0,0]=3 69 B12R2.132 O=C1NCc2c1cc(cc2)O 271570a_203496583355_100010171230 [0,1,0,0,0,0|1,0,0]=2 70 B12R2.132 O=C1OCc2c1cc(cc2)O 271570a_203496583355_100000693025 [0,1,0,0,0,0|0,0,0]=1 71 B12R2.132 O=c1[nH][nH]c2c1cc(cc2)O 271570a_203496583355_100012353726 [0,1,0,0,0,0|2,0,0]=3 72 B12R2.132 O=c1[nH]nc2n1cc(cc2)O 271570a_203496583355_100010235869 [0,1,0,0,0,0|3,0,0]=4 73 B12R2.132 O=c1[nH]oc2c1cc(cc2)O 271570a_203496583355_100000732257 [0,1,0,0,0,0|2,0,0]=3 74 B12R2.132 Oc1ccc2[nH]nc(c2c1)Br 271570a_203496583355_200012353728 [0,1,0,0,0,0|3,0,0]=4 75 B12R2.132 Oc1ccc2c(c1)C(CC2)O 271570a_203496583355_100011836024 [0,1,0,0,0,0|1,0,2]=4 76 B12R2.132 Oc1n[nH]c2c1cc(cc2)Br 271570a_203496583355_100010186058 [0,1,0,0,0,0|2,0,1]=4 77 B12R2.132 Oc1n[nH]c2c1cc(cc2)Cl 271570a_203496583355_100010174404 [0,1,0,0,0,0|2,0,1]=4 78 B12R2.132 Oc1n[nH]c2c1cc(cc2)F 271570a_203496583355_100011934747 [0,1,0,0,0,0|2,0,1]=4 79 B12R2.196 Cc1c[nH]c2c1cccc2O 271570a_203496583355_100010186758 [0,1,0,0,0,0|3,0,0]=4 80 B12R2.196 Cc1cccc2c1[nH]nc2O 271570a_203496583355_100010186057 [0,1,0,0,0,0|2,0,1]=4 81 B12R2.196 Cc1n[nH]c2c1cccc2O 271570a_203496583355_100010255084 [0,1,0,0,0,0|3,0,0]=4 82 B12R2.196 NC1CCc2c1cccc2O 271570a_203496583355_100000751068 [0,1,0,0,0,0|2,0,1]=4 83 B12R2.196 Nc1cccc2c1[nH]nc2O 271570a_203496583355_100009888981 [0,1,0,0,0,0|2,0,1]=4 84 B12R2.196 Nc1n[nH]c2c1cccc2O 271570a_203496583355_100010069757 [0,1,0,0,0,0|3,0,0]=4 85 B12R2.196 Nc1noc2c1cccc2O 271570a_203496583355_100010069758 [0,1,0,0,0,0|3,0,0]=4 86 B12R2.196 O=C1CCc2c1cccc2O 271570a_203496583355_100000744605 [0,1,0,0,0,0|1,0,0]=2 87 B12R2.196 O=C1COc2c1cccc2O 271570a_203496583355_100011230590 [0,1,0,0,0,0|2,0,0]=3 88 B12R2.196 O=C1NCc2c1cccc2O 271570a_203496583355_100000688282 [0,1,0,0,0,0|1,0,0]=2 89 B12R2.196 O=C1OCc2c1cccc2O 271570a_203496583355_100010167076 [0,1,0,0,0,0|0,0,0]=1 90 B12R2.196 O=c1[nH][nH]c2c1cccc2O 271570a_203496583355_100012199144 [0,1,0,0,0,0|2,0,0]=3 91 B12R2.196 Oc1cccc2c1CC[C@@H]2O 271570a_203496583355_100010080924 [0,1,0,0,0,0|1,0,2]=4 92 B12R2.196 Oc1n[nH]c2c1cccc2Br 271570a_203496583355_100010197283 [0,1,0,0,0,0|2,0,1]=4 93 B12R2.196 Oc1n[nH]c2c1cccc2Cl 271570a_203496583355_100000050086 [0,1,0,0,0,0|2,0,1]=4 94 B12R2.196 Oc1n[nH]c2c1cccc2F 271570a_203496583355_100010231504 [0,1,0,0,0,0|2,0,1]=4 95 B12R2.196 Oc1n[nH]c2c1cccc2O 271570a_203496583355_200010988877 [0,1,0,0,0,0|2,0,1]=4 96 B12R2.203 Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100010194227 [0,1,0,0,0,0|3,0,0]=4 97 B12R2.203 Cc1cccc2c1c(n[nH]2)O 271570a_203496583355_100000049903 [0,1,0,0,0,0|2,0,1]=4 98 B12R2.203 Cc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100010205804 [0,1,0,0,0,0|3,0,0]=4 99 B12R2.203 NC1CCc2c1c(ccc2)O 271570a_203496583355_100103168669 [0,1,0,0,0,0|2,0,1]=4 100 B12R2.203 Nc1cccc2c1c(n[nH]2)O 271570a_203496583355_100010186038 [0,1,0,0,0,0|2,0,1]=4 101 B12R2.203 Nc1n[nH]c2c1c(ccc2)O 271570a_203496583355_100000049960 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.203 Nc1noc2c1c(ccc2)O 271570a_203496583355_100012361266 [0,1,0,0,0,0|3,0,0]=4 103 B12R2.203 O=C1CCc2c1c(ccc2)O 271570a_203496583355_100009816781 [0,1,0,0,0,0|1,0,0]=2 104 B12R2.203 O=C1COc2c1c(ccc2)O 271570a_203496583355_100010205902 [0,1,0,0,0,0|2,0,0]=3 105 B12R2.203 O=C1NCc2c1c(ccc2)O 271570a_203496583355_100000724024 [0,1,0,0,0,0|1,0,0]=2 106 B12R2.203 O=C1OCc2c1c(ccc2)O 271570a_203496583355_100010132333 [0,1,0,0,0,0|0,0,0]=1 107 B12R2.203 O=c1[nH][nH]c2c1c(ccc2)O 271570a_203496583355_100010170957 [0,1,0,0,0,0|2,0,0]=3 108 B12R2.203 Oc1n[nH]c2c1c(ccc2)Br 271570a_203496583355_100010186043 [0,1,0,0,0,0|2,0,1]=4 109 B12R2.203 Oc1n[nH]c2c1c(ccc2)Cl 271570a_203496583355_100000049730 [0,1,0,0,0,0|2,0,1]=4 110 B12R2.203 Oc1n[nH]c2c1c(ccc2)F 271570a_203496583355_100000049989 [0,1,0,0,0,0|2,0,1]=4 111 B12R2.612 CN1CCc2c1ccc(c2)O 271570a_203496583355_100009815432 [0,1,0,0,0,0|3,0,0]=4 112 B12R2.612 Cc1c[nH]c2c1ccc(c2)O 271570a_203496583355_100010209589 [0,1,0,0,0,0|3,0,0]=4 113 B12R2.612 Cc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100000049534 [0,1,0,0,0,0|2,0,1]=4 114 B12R2.612 Cc1coc2c1ccc(c2)O 271570a_203496583355_100010775837 [0,1,0,0,0,0|3,0,0]=4 115 B12R2.612 Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009816850 [0,1,0,0,0,0|3,0,0]=4 116 B12R2.612 Cc1noc2c1ccc(c2)O 271570a_203496583355_100009815287 [0,1,0,0,0,0|3,0,0]=4 117 B12R2.612 NC1CCc2c1ccc(c2)O 271570a_203496583355_100000744021 [0,1,0,0,0,0|2,0,1]=4 118 B12R2.612 Nc1ccc2c(n[nH]c2c1)O 271570a_203496583355_100009816878 [0,1,0,0,0,0|2,0,1]=4 119 B12R2.612 Nc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100011934401 [0,1,0,0,0,0|3,0,0]=4 120 B12R2.612 Nc1noc2c1ccc(c2)O 271570a_203496583355_100012356334 [0,1,0,0,0,0|3,0,0]=4 121 B12R2.612 O=C1C=Cc2c1ccc(c2)O 271570a_203496583355_100010210589 [0,1,0,0,0,0|1,0,1]=3 122 B12R2.612 O=C1CCc2c1ccc(c2)O 271570a_203496583355_100000737041 [0,1,0,0,0,0|1,0,0]=2 123 B12R2.612 O=C1COc2c1ccc(c2)O 271570a_203496583355_100000686717 [0,1,0,0,0,0|2,0,0]=3 124 B12R2.612 O=C1NCc2c1ccc(c2)O 271570a_203496583355_100000692135 [0,1,0,0,0,0|1,0,0]=2 125 B12R2.612 O=C1NCc2c1ccc(n2)O 271570a_203496583355_200009864240 [0,1,0,0,0,0|2,0,0]=3 126 B12R2.612 O=C1OCc2c1ccc(c2)O 271570a_203496583355_100009816608 [0,1,0,0,0,0|0,0,0]=1 127 B12R2.612 O=c1[nH][nH]c2c1ccc(c2)O 271570a_203496583355_100012353722 [0,1,0,0,0,0|2,0,0]=3 128 B12R2.612 O=c1[nH][nH]c2c1cnc(c2)O 271570a_203496583355_100016039622 [0,1,0,0,0,0|3,0,0]=4 129 B12R2.612 Oc1ccc2c(c1)CCC2O 271570a_203496583355_100000747877 [0,1,0,0,0,0|1,0,2]=4 130 B12R2.612 Oc1ccc2c(noc2c1)O 271570a_203496583355_100000727085 [0,1,0,0,0,0|2,0,1]=4 131 B12R2.612 Oc1n[nH]c2c1ccc(c2)Br 271570a_203496583355_100010186045 [0,1,0,0,0,0|2,0,1]=4 132 B12R2.612 Oc1n[nH]c2c1ccc(c2)Cl 271570a_203496583355_100000049627 [0,1,0,0,0,0|2,0,1]=4 133 B12R2.612 Oc1n[nH]c2c1ccc(c2)F 271570a_203496583355_100000049990 [0,1,0,0,0,0|2,0,1]=4 134 B12R2.2028 Cn1nc(c2c1cccc2)O 271570a_203496583355_100009817141 [0,1,0,0,0,0|2,0,1]=4 135 B10R1.15 CC(S[13CH3])c1ccccc1 62a_100000230085_200025704644 [0,0,1,0,0,0|1,1,1]=4 136 B10R1.15 CC(S[13CH3])c1ccccc1 62a_200025704644_100000230085 [0,0,1,0,0,0|1,1,1]=4 137 B10R1.15 CCC(=O)c1ccccc1 1458a_100000185807_100000210202 [0,0,1,0,0,0|1,0,0]=2 138 B10R1.15 CCN(C)c1ccccc1 2230a_100000210012_100000210202 [0,0,1,0,0,0|3,0,0]=4 139 B10R1.15 CCN(C)c1ccccc1 2230a_100000210013_200000210301 [0,0,1,0,0,0|3,0,0]=4 140 B10R1.15 CCN(C)c1ccccc1 269982a_100000210012_100000204670 [0,0,1,0,0,0|3,0,0]=4 141 B10R1.15 CCN(C)c1ccccc1 269982a_100000210013_200000210301 [0,0,1,0,0,0|3,0,0]=4 142 B10R1.15 CCN(C)c1ccccc1 34a_100000210012_100000210202 [0,0,1,0,0,0|3,0,0]=4 143 B10R1.15 CCN(C)c1ccccc1 34a_100000210013_200000210301 [0,0,1,0,0,0|3,0,0]=4 144 B10R1.15 CCN([13CH3])c1ccccc1 2230a_100000210013_200025704644 [0,0,1,0,0,0|3,0,0]=4 145 B10R1.15 CCN([13CH3])c1ccccc1 269982a_100000210013_200025704644 [0,0,1,0,0,0|3,0,0]=4 146 B10R1.15 CCN([13CH3])c1ccccc1 34a_100000210013_200025704644 [0,0,1,0,0,0|3,0,0]=4 147 B10R1.15 CNC(=O)c1ccccc1 11a_106832991635_100000185807 [0,0,1,0,0,0|1,0,0]=2 148 B10R1.15 CNC(=O)c1ccccc1 1626a_100102657272_100000185807 [0,0,1,0,0,0|1,0,0]=2 149 B10R1.15 CNC(=O)c1ccccc1 240690a_100102657272_100000185807 [0,0,1,0,0,0|1,0,0]=2 150 B10R1.15 CNC(=O)c1ccccc1 527a_100102657272_100000185807 [0,0,1,0,0,0|1,0,0]=2 151 B10R1.15 CNC(C)c1ccccc1 2230a_106832991635_100000230085 [0,0,1,0,0,0|2,0,1]=4 152 B10R1.15 CNC(C)c1ccccc1 269862a_106832991636_100000185851 [0,0,1,0,0,0|2,0,1]=4 153 B10R1.15 CNC(C)c1ccccc1 34a_100102657272_100000211855 [0,0,1,0,0,0|2,0,1]=4 154 B10R1.15 CNC(C)c1ccccc1 7a_106832991635_100000230085 [0,0,1,0,0,0|2,0,1]=4 155 B10R1.15 CN[C@H](C)c1ccccc1 2230a_100000751104_200000210301 [0,0,1,0,0,0|2,0,1]=4 156 B10R1.15 COC(C)c1ccccc1 34a_100138415774_100000211855 [0,0,1,0,0,0|1,0,1]=3 157 B10R1.15 CO[C@H](C)c1ccccc1 34a_100000761318_200000210301 [0,0,1,0,0,0|1,0,1]=3 158 B10R1.15 CO[C@H](C)c1ccccc1 7a_100000761318_200000210301 [0,0,1,0,0,0|1,0,1]=3 159 B10R1.15 CSC(C)c1ccccc1 62a_100000230085_200000210301 [0,0,1,0,0,0|1,1,1]=4 160 B10R1.15 CSC(C)c1ccccc1 62a_200000210301_100000230085 [0,0,1,0,0,0|1,1,1]=4 161 B10R1.15 C[C@@H](N[13CH3])c1ccccc1 2230a_100000751104_200025704644 [0,0,1,0,0,0|2,0,1]=4 162 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 34a_100000761318_200025704644 [0,0,1,0,0,0|1,0,1]=3 163 B10R1.15 C[C@@H](O[13CH3])c1ccccc1 7a_100000761318_200025704644 [0,0,1,0,0,0|1,0,1]=3 164 B10R1.15 O=C(CF)c1ccccc1 1458a_100000185807_100015361967 [0,0,1,0,0,0|2,0,0]=3 165 B10R1.17 C=CCNc1ccccc1 34a_100000106764_100015514636 [0,0,1,0,0,0|3,0,0]=4 166 B10R1.17 C=CCOc1ccccc1 34a_100000210340_100015514636 [0,0,1,0,0,0|3,0,0]=4 167 B10R1.17 C=CCOc1ccccc1 7a_100000210340_100015514636 [0,0,1,0,0,0|3,0,0]=4 168 B10R1.17 C=CCSc1ccccc1 62a_100000210623_100000041952 [0,0,1,0,0,0|3,0,0]=4 169 B10R1.17 C=CCSc1ccccc1 62a_100000719477_100000210623 [0,0,1,0,0,0|3,0,0]=4 170 B10R1.17 CC=NNc1ccccc1 4a_100015195140_200000210099 [0,0,1,0,0,0|3,0,0]=4 171 B10R1.17 CCCCc1ccccc1 271570a_100020621405_100000210277 [0,0,1,0,0,0|2,0,1]=4 172 B10R1.17 CCNCc1ccccc1 207a_100015525214_100015611070 [0,0,1,0,0,0|2,0,1]=4 173 B10R1.17 CCNCc1ccccc1 2230a_100015324214_100000210202 [0,0,1,0,0,0|2,0,1]=4 174 B10R1.17 CCNCc1ccccc1 2230a_100015525214_100015291786 [0,0,1,0,0,0|2,0,1]=4 175 B10R1.17 CCNCc1ccccc1 270004a_100015525214_100015611070 [0,0,1,0,0,0|2,0,1]=4 176 B10R1.17 CCNCc1ccccc1 34a_100015324214_100000210202 [0,0,1,0,0,0|2,0,1]=4 177 B10R1.17 CCOCc1ccccc1 34a_100000210790_100000210202 [0,0,1,0,0,0|1,0,1]=3 178 B10R1.17 CCOCc1ccccc1 34a_100121572206_100015291786 [0,0,1,0,0,0|1,0,1]=3 179 B10R1.17 CCOCc1ccccc1 7a_100000210790_100000210202 [0,0,1,0,0,0|1,0,1]=3 180 B10R1.17 CCOCc1ccccn1 34a_100121572206_100000721315 [0,0,1,0,0,0|2,0,1]=4 181 B10R1.17 CCOCc1cccnc1 34a_100121572206_100000733263 [0,0,1,0,0,0|2,0,1]=4 182 B10R1.17 CCSCc1ccccc1 62a_100000210202_100015291786 [0,0,1,0,0,0|1,1,1]=4 183 B10R1.17 CCSCc1ccccc1 62a_100000211182_100000210202 [0,0,1,0,0,0|1,1,1]=4 184 B10R1.17 CNCCc1ccccc1 2230a_100000106460_200000210301 [0,0,1,0,0,0|3,0,0]=4 185 B10R1.17 CNCCc1ccccc1 2230a_106832991635_100000765856 [0,0,1,0,0,0|3,0,0]=4 186 B10R1.17 CNCCc1ccccc1 34a_100000106460_200000210301 [0,0,1,0,0,0|3,0,0]=4 187 B10R1.17 CNCCc1ccccc1 34a_100102657272_100000765856 [0,0,1,0,0,0|3,0,0]=4 188 B10R1.17 CNCCc1ccccc1 7a_106832991635_100000765856 [0,0,1,0,0,0|3,0,0]=4 189 B10R1.17 COCCc1ccccc1 34a_100000210268_200000210301 [0,0,1,0,0,0|3,0,0]=4 190 B10R1.17 COCCc1ccccc1 34a_100138415774_100000765856 [0,0,1,0,0,0|3,0,0]=4 191 B10R1.17 COCCc1ccccc1 7a_100000210268_200000210301 [0,0,1,0,0,0|3,0,0]=4 192 B10R1.17 CSCCc1ccccc1 62a_100000765856_200000210301 [0,0,1,0,0,0|3,0,0]=4 193 B10R1.17 CSCCc1ccccc1 62a_200000210301_100011218657 [0,0,1,0,0,0|3,0,0]=4 194 B10R1.17 FCNCc1ccccc1 34a_100015324214_100015361967 [0,0,1,0,0,0|2,0,1]=4 195 B10R1.17 FCOCc1ccccc1 34a_100000210790_100015361967 [0,0,1,0,0,0|1,0,1]=3 196 B10R1.17 FCOCc1ccccc1 7a_100000210790_100015361967 [0,0,1,0,0,0|1,0,1]=3 197 B10R1.17 FCSCc1ccccc1 62a_100000211182_100015361967 [0,0,1,0,0,0|1,1,1]=4 198 B10R1.17 FCSCc1ccccc1 62a_100015361967_100015291786 [0,0,1,0,0,0|1,1,1]=4 199 B10R1.17 O=CCNc1ccccc1 34a_100000106764_200009817547 [0,0,1,0,0,0|2,0,0]=3 200 B10R1.17 O=CCOc1ccccc1 34a_100000210340_200009817547 [0,0,1,0,0,0|2,0,0]=3 201 B10R1.17 O=CCOc1ccccc1 7a_100000210340_200015260668 [0,0,1,0,0,0|2,0,0]=3 202 B10R1.17 O=CCOc1cccnc1 34a_100000210849_200009817547 [0,0,1,0,0,0|3,0,0]=4 203 B10R1.17 O=CCOc1cccnc1 7a_100000210849_200015260668 [0,0,1,0,0,0|3,0,0]=4 204 B10R1.17 O=CCOc1ccncc1 34a_100000212176_200009817547 [0,0,1,0,0,0|3,0,0]=4 205 B10R1.17 O=CCSc1ccccc1 62a_100000719477_200015260668 [0,0,1,0,0,0|2,0,0]=3 206 B10R1.17 O=CCSc1ccccc1 62a_200015260668_100000041952 [0,0,1,0,0,0|2,0,0]=3 207 B10R1.17 O=CCSc1ccccn1 62a_100011216584_200015260668 [0,0,1,0,0,0|3,0,0]=4 208 B10R1.17 O=CCSc1ccccn1 62a_200015260668_100011216584 [0,0,1,0,0,0|3,0,0]=4 209 B10R1.17 O=CCSc1cccnc1 62a_100000210063_200015260668 [0,0,1,0,0,0|3,0,0]=4 210 B10R1.17 O=CCSc1cccnc1 62a_200015260668_100000210063 [0,0,1,0,0,0|3,0,0]=4 211 B10R1.17 O=CCSc1ccncc1 62a_100000728582_200015260668 [0,0,1,0,0,0|3,0,0]=4 212 B10R1.17 O=CCSc1ccncc1 62a_200015260668_100000728582 [0,0,1,0,0,0|3,0,0]=4 213 B10R1.17 [13CH3]NCCc1ccccc1 2230a_100000106460_200025704644 [0,0,1,0,0,0|3,0,0]=4 214 B10R1.17 [13CH3]NCCc1ccccc1 34a_100000106460_200025704644 [0,0,1,0,0,0|3,0,0]=4 215 B10R1.17 [13CH3]OCCc1ccccc1 34a_100000210268_200025704644 [0,0,1,0,0,0|3,0,0]=4 216 B10R1.17 [13CH3]OCCc1ccccc1 7a_100000210268_200025704644 [0,0,1,0,0,0|3,0,0]=4 217 B10R1.17 [13CH3]SCCc1ccccc1 62a_100000765856_200025704644 [0,0,1,0,0,0|3,0,0]=4 218 B10R1.17 [13CH3]SCCc1ccccc1 62a_200025704644_100011218657 [0,0,1,0,0,0|3,0,0]=4 219 B10R1.20 C=Cc1ccccc1C#N 271570a_100011290941_100000188569 [0,0,1,0,0,0|2,0,1]=4 220 B10R1.20 C=Cc1ccccc1C=O 271570a_100011290941_100000211189 [0,0,1,0,0,0|1,0,1]=3 221 B10R1.20 C=Cc1ccccc1CC 271570a_100011290941_100011215823 [0,0,1,0,0,0|2,0,0]=3 222 B10R1.20 C=Cc1ccccc1CN 271570a_100011290941_100000689332 [0,0,1,0,0,0|2,0,0]=3 223 B10R1.20 C=Cc1ccccc1CO 271570a_100011290941_100000187465 [0,0,1,0,0,0|1,0,0]=2 224 B10R1.20 C=Cc1ccccc1NC 271570a_100011290941_100020606079 [0,0,1,0,0,0|3,0,0]=4 225 B10R1.20 C=Cc1ccccc1NC 34a_100012022501_200000210301 [0,0,1,0,0,0|3,0,0]=4 226 B10R1.20 C=Cc1ccccc1NN 271570a_100011290941_100000241748 [0,0,1,0,0,0|3,0,0]=4 227 B10R1.20 C=Cc1ccccc1N[13CH3] 34a_100012022501_200025704644 [0,0,1,0,0,0|3,0,0]=4 228 B10R1.20 C=Cc1ccccc1OC 271570a_100011290941_100000174000 [0,0,1,0,0,0|3,0,0]=4 229 B10R1.20 C=Cc1ccccc1SC 271570a_100011290941_100011217816 [0,0,1,0,0,0|3,0,0]=4 230 B10R1.20 C=Cc1ccccc1SC 62a_100011218376_200000210301 [0,0,1,0,0,0|3,0,0]=4 231 B10R1.20 C=Cc1ccccc1SC 62a_200000210301_100011218376 [0,0,1,0,0,0|3,0,0]=4 232 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_100011218376_200025704644 [0,0,1,0,0,0|3,0,0]=4 233 B10R1.20 C=Cc1ccccc1S[13CH3] 62a_200025704644_100011218376 [0,0,1,0,0,0|3,0,0]=4 234 B10R1.20 C=Cc1cccnc1C=O 271570a_100011290941_100011934733 [0,0,1,0,0,0|2,0,1]=4 235 B10R1.20 C=Cc1cccnc1CC 271570a_100011290941_100009877225 [0,0,1,0,0,0|3,0,0]=4 236 B10R1.20 C=Cc1cccnc1CN 271570a_100011290941_100020591323 [0,0,1,0,0,0|3,0,0]=4 237 B10R1.20 C=Cc1cccnc1CO 271570a_100011290941_100011996772 [0,0,1,0,0,0|2,0,0]=3 238 B10R1.20 C=Cc1ccncc1C=O 271570a_100011290941_100000050567 [0,0,1,0,0,0|2,0,1]=4 239 B10R1.20 C=Cc1ccncc1CC 271570a_100011290941_100025704421 [0,0,1,0,0,0|3,0,0]=4 240 B10R1.20 C=Cc1ccncc1CO 271570a_100011290941_100000117392 [0,0,1,0,0,0|2,0,0]=3 241 B10R1.20 C=Cc1cnccc1C=O 271570a_100011290941_100011934409 [0,0,1,0,0,0|2,0,1]=4 242 B10R1.20 C=Cc1cnccc1CC 271570a_100011290941_100009819861 [0,0,1,0,0,0|3,0,0]=4 243 B10R1.20 C=Cc1cnccc1CN 271570a_100011290941_100020640021 [0,0,1,0,0,0|3,0,0]=4 244 B10R1.20 C=Cc1cnccc1CO 271570a_100011290941_100009873359 [0,0,1,0,0,0|2,0,0]=3 245 B10R1.20 C=Cc1ncccc1C=O 271570a_100011290941_100009816751 [0,0,1,0,0,0|2,0,1]=4 246 B10R1.20 C=Cc1ncccc1CN 271570a_100011290941_100015189234 [0,0,1,0,0,0|3,0,0]=4 247 B10R1.20 C=Cc1ncccc1CO 271570a_100011290941_100000748726 [0,0,1,0,0,0|2,0,0]=3 248 B10R1.20 C=Cc1nccnc1CO 271570a_100011290941_100000057004 [0,0,1,0,0,0|3,0,0]=4 249 B10R1.20 CCc1ccccc1NC 2230a_100000212081_200000210301 [0,0,1,0,0,0|3,0,0]=4 250 B10R1.20 CCc1ccccc1NC 34a_100000212081_200000210301 [0,0,1,0,0,0|3,0,0]=4 251 B10R1.20 CCc1ccccc1NC 7a_100000212081_200000210301 [0,0,1,0,0,0|3,0,0]=4 252 B10R1.20 CCc1ccccc1N[13CH3] 2230a_100000212081_200025704644 [0,0,1,0,0,0|3,0,0]=4 253 B10R1.20 CCc1ccccc1N[13CH3] 34a_100000212081_200025704644 [0,0,1,0,0,0|3,0,0]=4 254 B10R1.20 CCc1ccccc1N[13CH3] 7a_100000212081_200025704644 [0,0,1,0,0,0|3,0,0]=4 255 B10R1.20 CCc1ccccc1OC 34a_100000210936_200000210301 [0,0,1,0,0,0|3,0,0]=4 256 B10R1.20 CCc1ccccc1OC 7a_100000210936_200000210301 [0,0,1,0,0,0|3,0,0]=4 257 B10R1.20 CCc1ccccc1O[13CH3] 34a_100000210936_200025704644 [0,0,1,0,0,0|3,0,0]=4 258 B10R1.20 CCc1ccccc1O[13CH3] 7a_100000210936_200025704644 [0,0,1,0,0,0|3,0,0]=4 259 B10R1.20 CCc1ccccc1SC 62a_100011215823_200000210301 [0,0,1,0,0,0|3,0,0]=4 260 B10R1.20 CCc1ccccc1SC 62a_200000210301_100011215823 [0,0,1,0,0,0|3,0,0]=4 261 B10R1.20 CCc1ccccc1S[13CH3] 62a_100011215823_200025704644 [0,0,1,0,0,0|3,0,0]=4 262 B10R1.20 CCc1ccccc1S[13CH3] 62a_200025704644_100011215823 [0,0,1,0,0,0|3,0,0]=4 263 B10R1.20 CNc1ccccc1CO 34a_100000212039_200000210301 [0,0,1,0,0,0|2,0,0]=3 264 B10R1.20 CNc1ccncc1CO 27a_100102657272_100000117392 [0,0,1,0,0,0|3,0,0]=4 265 B10R1.20 COc1ccccc1CN 34a_100000185550_200000210301 [0,0,1,0,0,0|3,0,0]=4 266 B10R1.20 COc1ccccc1CO 34a_100011216872_200000210301 [0,0,1,0,0,0|2,0,0]=3 267 B10R1.20 COc1cccnc1CO 34a_100000731849_200000210301 [0,0,1,0,0,0|3,0,0]=4 268 B10R1.20 COc1cnccc1CO 34a_100000078615_200000210301 [0,0,1,0,0,0|3,0,0]=4 269 B10R1.20 CSc1ccccc1C=O 62a_100000210073_200000210301 [0,0,1,0,0,0|2,0,0]=3 270 B10R1.20 CSc1ccccc1C=O 62a_200000210301_100000210073 [0,0,1,0,0,0|2,0,0]=3 271 B10R1.20 CSc1ccccc1CN 62a_100000689332_200000210301 [0,0,1,0,0,0|3,0,0]=4 272 B10R1.20 CSc1ccccc1CN 62a_200000210301_100000689332 [0,0,1,0,0,0|3,0,0]=4 273 B10R1.20 CSc1ccccc1CO 62a_100000187465_200000210301 [0,0,1,0,0,0|2,0,0]=3 274 B10R1.20 CSc1ccccc1CO 62a_200000210301_100000187465 [0,0,1,0,0,0|2,0,0]=3 275 B10R1.20 CSc1cccnc1C=O 62a_100011934733_200000210301 [0,0,1,0,0,0|3,0,0]=4 276 B10R1.20 CSc1cccnc1C=O 62a_200000210301_100011934733 [0,0,1,0,0,0|3,0,0]=4 277 B10R1.20 CSc1cccnc1CO 62a_100011996772_200000210301 [0,0,1,0,0,0|3,0,0]=4 278 B10R1.20 CSc1cccnc1CO 62a_200000210301_100011996772 [0,0,1,0,0,0|3,0,0]=4 279 B10R1.20 CSc1ccncc1C=O 62a_100000050567_200000210301 [0,0,1,0,0,0|3,0,0]=4 280 B10R1.20 CSc1ccncc1C=O 62a_200000210301_100000050567 [0,0,1,0,0,0|3,0,0]=4 281 B10R1.20 CSc1ccncc1CO 62a_100000117392_200000210301 [0,0,1,0,0,0|3,0,0]=4 282 B10R1.20 CSc1ccncc1CO 62a_200000210301_100000117392 [0,0,1,0,0,0|3,0,0]=4 283 B10R1.20 CSc1cnccc1C=O 62a_100011934409_200000210301 [0,0,1,0,0,0|3,0,0]=4 284 B10R1.20 CSc1cnccc1C=O 62a_200000210301_100011934409 [0,0,1,0,0,0|3,0,0]=4 285 B10R1.20 CSc1cnccc1CO 62a_100009873359_200000210301 [0,0,1,0,0,0|3,0,0]=4 286 B10R1.20 CSc1cnccc1CO 62a_200000210301_100009873359 [0,0,1,0,0,0|3,0,0]=4 287 B10R1.20 CSc1ncccc1C=O 62a_100009816751_200000210301 [0,0,1,0,0,0|3,0,0]=4 288 B10R1.20 CSc1ncccc1C=O 62a_200000210301_100009816751 [0,0,1,0,0,0|3,0,0]=4 289 B10R1.20 CSc1ncccc1CO 62a_100000748726_200000210301 [0,0,1,0,0,0|3,0,0]=4 290 B10R1.20 CSc1ncccc1CO 62a_200000210301_100000748726 [0,0,1,0,0,0|3,0,0]=4 291 B10R1.20 [13CH3]Nc1ccccc1CO 34a_100000212039_200025704644 [0,0,1,0,0,0|2,0,0]=3 292 B10R1.20 [13CH3]Oc1ccccc1CN 34a_100000185550_200025704644 [0,0,1,0,0,0|3,0,0]=4 293 B10R1.20 [13CH3]Oc1ccccc1CO 34a_100011216872_200025704644 [0,0,1,0,0,0|2,0,0]=3 294 B10R1.20 [13CH3]Oc1cccnc1CO 34a_100000731849_200025704644 [0,0,1,0,0,0|3,0,0]=4 295 B10R1.20 [13CH3]Oc1cnccc1CO 34a_100000078615_200025704644 [0,0,1,0,0,0|3,0,0]=4 296 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_100000210073_200025704644 [0,0,1,0,0,0|2,0,0]=3 297 B10R1.20 [13CH3]Sc1ccccc1C=O 62a_200025704644_100000210073 [0,0,1,0,0,0|2,0,0]=3 298 B10R1.20 [13CH3]Sc1ccccc1CN 62a_100000689332_200025704644 [0,0,1,0,0,0|3,0,0]=4 299 B10R1.20 [13CH3]Sc1ccccc1CN 62a_200025704644_100000689332 [0,0,1,0,0,0|3,0,0]=4 300 B10R1.20 [13CH3]Sc1ccccc1CO 62a_100000187465_200025704644 [0,0,1,0,0,0|2,0,0]=3 301 B10R1.20 [13CH3]Sc1ccccc1CO 62a_200025704644_100000187465 [0,0,1,0,0,0|2,0,0]=3 302 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_100011934733_200025704644 [0,0,1,0,0,0|3,0,0]=4 303 B10R1.20 [13CH3]Sc1cccnc1C=O 62a_200025704644_100011934733 [0,0,1,0,0,0|3,0,0]=4 304 B10R1.20 [13CH3]Sc1cccnc1CO 62a_100011996772_200025704644 [0,0,1,0,0,0|3,0,0]=4 305 B10R1.20 [13CH3]Sc1cccnc1CO 62a_200025704644_100011996772 [0,0,1,0,0,0|3,0,0]=4 306 B10R1.20 [13CH3]Sc1ccncc1C=O 62a_100000050567_200025704644 [0,0,1,0,0,0|3,0,0]=4 307 B10R1.20 [13CH3]Sc1ccncc1C=O 62a_200025704644_100000050567 [0,0,1,0,0,0|3,0,0]=4 308 B10R1.20 [13CH3]Sc1ccncc1CO 62a_100000117392_200025704644 [0,0,1,0,0,0|3,0,0]=4 309 B10R1.20 [13CH3]Sc1ccncc1CO 62a_200025704644_100000117392 [0,0,1,0,0,0|3,0,0]=4 310 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_100011934409_200025704644 [0,0,1,0,0,0|3,0,0]=4 311 B10R1.20 [13CH3]Sc1cnccc1C=O 62a_200025704644_100011934409 [0,0,1,0,0,0|3,0,0]=4 312 B10R1.20 [13CH3]Sc1cnccc1CO 62a_100009873359_200025704644 [0,0,1,0,0,0|3,0,0]=4 313 B10R1.20 [13CH3]Sc1cnccc1CO 62a_200025704644_100009873359 [0,0,1,0,0,0|3,0,0]=4 314 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_100009816751_200025704644 [0,0,1,0,0,0|3,0,0]=4 315 B10R1.20 [13CH3]Sc1ncccc1C=O 62a_200025704644_100009816751 [0,0,1,0,0,0|3,0,0]=4 316 B10R1.20 [13CH3]Sc1ncccc1CO 62a_100000748726_200025704644 [0,0,1,0,0,0|3,0,0]=4 317 B10R1.20 [13CH3]Sc1ncccc1CO 62a_200025704644_100000748726 [0,0,1,0,0,0|3,0,0]=4 318 B10R1.61 C=C(C)c1cccc[n+]1C 271570a_100000694244_100000212160 [0,0,1,0,0,0|3,0,0]=4 319 B10R1.61 C=C(C)c1ccccc1Br 271570a_100000694244_100000695589 [0,0,1,0,0,0|3,0,0]=4 320 B10R1.61 C=C(C)c1ccccc1C 271570a_100000694244_100000210755 [0,0,1,0,0,0|2,0,0]=3 321 B10R1.61 C=C(C)c1ccccc1Cl 271570a_100000694244_100000764095 [0,0,1,0,0,0|3,0,0]=4 322 B10R1.61 C=C(C)c1ccccc1F 271570a_100000694244_100011215700 [0,0,1,0,0,0|3,0,0]=4 323 B10R1.61 C=C(C)c1ccccc1N 271570a_100000694244_100000210017 [0,0,1,0,0,0|3,0,0]=4 324 B10R1.61 C=C(C)c1ccccc1O 271570a_100000694244_100000739446 [0,0,1,0,0,0|3,0,0]=4 325 B10R1.61 C=C(C)c1cccnc1C 271570a_100000694244_100000751574 [0,0,1,0,0,0|3,0,0]=4 326 B10R1.61 C=C(C)c1ccncc1C 271570a_100000694244_100015191297 [0,0,1,0,0,0|3,0,0]=4 327 B10R1.61 C=C(C)c1cnccc1C 271570a_100000694244_100000761580 [0,0,1,0,0,0|3,0,0]=4 328 B10R1.61 C=C(C)c1ncccc1C 271570a_100000694244_100000751373 [0,0,1,0,0,0|3,0,0]=4 329 B10R1.61 CC(=O)c1ccccc1Br 1458a_100000188424_200000210301 [0,0,1,0,0,0|2,0,0]=3 330 B10R1.61 CC(=O)c1ccccc1C 1458a_100000212026_200000210301 [0,0,1,0,0,0|1,0,0]=2 331 B10R1.61 CC(=O)c1ccccc1Cl 1458a_100000185844_200000210301 [0,0,1,0,0,0|2,0,0]=3 332 B10R1.61 CC(=O)c1ccccc1F 1458a_100000188656_200000210301 [0,0,1,0,0,0|2,0,0]=3 333 B10R1.61 CC(=O)c1ccccc1I 1458a_100000187884_200000210301 [0,0,1,0,0,0|2,0,0]=3 334 B10R1.61 CC(=O)c1ccccc1O 1458a_100015234032_200000210301 [0,0,1,0,0,0|2,0,0]=3 335 B10R1.61 CC(=O)c1ccccc1O 271570a_203496583355_100000751169 [0,0,1,0,0,0|2,0,0]=3 336 B10R1.61 CC(=O)c1ccccc1[O-] 1458a_100009911694_200000210301 [0,0,1,0,0,0|2,0,0]=3 337 B10R1.61 CC(=O)c1cccnc1O 271570a_203496583355_100000753718 [0,0,1,0,0,0|3,0,0]=4 338 B10R1.61 CC(=O)c1ccncc1O 271570a_203496583355_100009993184 [0,0,1,0,0,0|3,0,0]=4 339 B10R1.61 CC(=O)c1cnccc1O 271570a_203496583355_100160469449 [0,0,1,0,0,0|3,0,0]=4 340 B10R1.61 CC(=O)c1ncccc1O 271570a_203496583355_100012348690 [0,0,1,0,0,0|3,0,0]=4 341 B10R1.61 CC(O)c1ccccc1O 271570a_203496583355_100000702211 [0,0,1,0,0,0|2,0,1]=4 342 B10R1.61 CS(=O)c1ccccc1O 271570a_203496583355_100000734199 [0,0,1,0,0,0|3,0,0]=4 343 B10R1.61 Cc1ccccc1C(=O)[13CH3] 1458a_100000212026_200025704644 [0,0,1,0,0,0|1,0,0]=2 344 B10R1.61 Cc1ccccc1N(C)C 2230a_100000219699_200000210301 [0,0,1,0,0,0|3,0,0]=4 345 B10R1.61 Cc1ccccc1N(C)C 269982a_100000219699_200000210301 [0,0,1,0,0,0|3,0,0]=4 346 B10R1.61 Cc1ccccc1N(C)C 34a_100000219699_200000210301 [0,0,1,0,0,0|3,0,0]=4 347 B10R1.61 Cc1ccccc1N(C)[13CH3] 2230a_100000219699_200025704644 [0,0,1,0,0,0|3,0,0]=4 348 B10R1.61 Cc1ccccc1N(C)[13CH3] 269982a_100000219699_200025704644 [0,0,1,0,0,0|3,0,0]=4 349 B10R1.61 Cc1ccccc1N(C)[13CH3] 34a_100000219699_200025704644 [0,0,1,0,0,0|3,0,0]=4 350 B10R1.61 NC(=O)c1ccccc1O 271570a_203496583355_100000162227 [0,0,1,0,0,0|2,0,0]=3 351 B10R1.61 NC(=O)c1cccnc1O 271570a_203496583355_100000162199 [0,0,1,0,0,0|3,0,0]=4 352 B10R1.61 NC(=O)c1ccncc1O 271570a_203496583355_100010205435 [0,0,1,0,0,0|3,0,0]=4 353 B10R1.61 NC(=O)c1cnccc1O 271570a_203496583355_100000697804 [0,0,1,0,0,0|3,0,0]=4 354 B10R1.61 NC(=O)c1ncccc1O 271570a_203496583355_200012359670 [0,0,1,0,0,0|3,0,0]=4 355 B10R1.61 OB(O)c1ccccc1O 271570a_203496583355_100000693059 [0,0,1,0,0,0|2,0,1]=4 356 B10R1.61 [13CH3]C(=O)c1ccccc1Br 1458a_100000188424_200025704644 [0,0,1,0,0,0|2,0,0]=3 357 B10R1.61 [13CH3]C(=O)c1ccccc1Cl 1458a_100000185844_200025704644 [0,0,1,0,0,0|2,0,0]=3 358 B10R1.61 [13CH3]C(=O)c1ccccc1F 1458a_100000188656_200025704644 [0,0,1,0,0,0|2,0,0]=3 359 B10R1.61 [13CH3]C(=O)c1ccccc1I 1458a_100000187884_200025704644 [0,0,1,0,0,0|2,0,0]=3 360 B10R1.61 [13CH3]C(=O)c1ccccc1O 1458a_100015234032_200025704644 [0,0,1,0,0,0|2,0,0]=3 361 B10R1.61 [13CH3]C(=O)c1ccccc1[O-] 1458a_100009911694_200025704644 [0,0,1,0,0,0|2,0,0]=3 362 B12R2.24 CN1CCc2ccccc2C1 2230a_100000188457_200000210301 [0,0,0,0,0,1|3,0,0]=4 363 B12R2.24 CN1CCc2ccccc2C1 269982a_100000188457_200000210301 [0,0,0,0,0,1|3,0,0]=4 364 B12R2.24 CN1CCc2ccccc2C1 34a_100000188457_200000210301 [0,0,0,0,0,1|3,0,0]=4 365 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,1|1,0,2]=4 366 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,1|1,0,2]=4 367 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,1|1,0,2]=4 368 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,1|2,0,1]=4 369 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,1|2,0,1]=4 370 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,1|1,0,2]=4 371 B12R2.24 [13CH3]N1CCc2ccccc2C1 2230a_100000188457_200025704644 [0,0,0,0,0,1|3,0,0]=4 372 B12R2.24 [13CH3]N1CCc2ccccc2C1 269982a_100000188457_200025704644 [0,0,0,0,0,1|3,0,0]=4 373 B12R2.24 [13CH3]N1CCc2ccccc2C1 34a_100000188457_200025704644 [0,0,0,0,0,1|3,0,0]=4 374 B12R2.1081 Oc1cccc2c1cccc2 271570a_203496583355_100000210605 [0,0,0,0,0,1|1,0,2]=4 375 B12R2.1081 Oc1ccnc2c1cccc2 271570a_203496583355_100011215880 [0,0,0,0,0,1|1,0,2]=4 376 B12R2.1081 Oc1cncc2c1cccc2 271570a_203496583355_100000187577 [0,0,0,0,0,1|1,0,2]=4 377 B12R2.1081 Oc1cnnc2c1cccc2 271570a_203496583355_100000063506 [0,0,0,0,0,1|2,0,1]=4 378 B12R2.1081 Oc1nccc2c1cccc2 271570a_203496583355_100011934041 [0,0,0,0,0,1|1,0,2]=4 379 B12R2.1081 Oc1ncnc2c1cccc2 271570a_203496583355_100000217608 [0,0,0,0,0,1|1,0,2]=4 380 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [1,0,1,0,0,0|1,0,0]=3 381 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [1,0,1,0,0,0|2,0,0]=4 382 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [1,0,1,0,0,0|2,0,0]=4 383 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [1,0,1,0,0,0|2,0,0]=4 384 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [1,0,1,0,0,0|0,0,0]=2 385 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [1,0,1,0,0,0|2,0,0]=4 386 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [1,0,1,0,0,0|2,0,0]=4 387 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [1,0,1,0,0,0|2,0,0]=4 388 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [1,0,1,0,0,0|2,0,0]=4 389 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [1,0,1,0,0,0|2,0,0]=4 390 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [1,0,1,0,0,0|2,0,0]=4 391 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [1,0,1,0,0,0|0,0,0]=2 392 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,1,0,0,0|1,0,1]=4 393 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,1,0,0,0|1,0,0]=3 394 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,1,0,0,0|2,0,0]=4 395 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,1,0,0,0|2,0,0]=4 396 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,1,0,0,0|2,0,0]=4 397 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,1,0,0,0|2,0,0]=4 398 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,1,0,0,0|1,0,1]=4 399 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,1,0,0,0|1,0,1]=4 400 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,1,0,0,0|2,0,0]=4 401 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,1,0,0,0|2,0,0]=4 402 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,1,0,0,0|1,0,1]=4 403 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,1,0,0,0|1,0,1]=4 404 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,1,0,0,0|1,0,1]=4 405 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,1,0,0,0|1,0,1]=4 406 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,1,0,0,0|1,0,1]=4 407 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,1,0,0,0|1,0,1]=4 408 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,1,0,0,0|1,0,1]=4 409 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,1,0,0,0|0,0,1]=3 410 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,1,0,0,0|0,0,1]=3 411 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,1,0,0,0|0,0,1]=3 412 B9R1.8 COCc1ccccn1 34a_100138415774_100000721315 [1,0,1,0,0,0|1,0,1]=4 413 B9R1.8 COCc1cccnc1 34a_100138415774_100000733263 [1,0,1,0,0,0|1,0,1]=4 414 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,1,0,0,0|0,1,1]=4 415 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,1,0,0,0|0,1,1]=4 416 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 417 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 418 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,1,0,0,0|1,0,1]=4 419 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,1,0,0,0|1,0,1]=4 420 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,1,0,0,0|0,0,1]=3 421 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,1,0,0,0|0,0,1]=3 422 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,1,0,0,0|0,1,1]=4 423 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,1,0,0,0|0,1,1]=4 424 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [1,0,1,0,0,0|2,0,0]=4 425 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,1,0,0,0|2,0,0]=4 426 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,1,0,0,0|1,0,0]=3 427 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,1,0,0,0|2,0,0]=4 428 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,1,0,0,0|2,0,0]=4 429 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,1,0,0,0|2,0,0]=4 430 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,1,0,0,0|1,0,0]=3 431 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [1,0,1,0,0,0|2,0,0]=4 432 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [1,0,1,0,0,0|2,0,0]=4 433 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,1,0,0,0|2,0,0]=4 434 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [1,0,1,0,0,0|2,0,0]=4 435 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [1,0,1,0,0,0|2,0,0]=4 436 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,1,0,0,0|2,0,0]=4 437 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,1,0,0,0|1,0,1]=4 438 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,1,0,0,0|2,0,0]=4 439 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,1,0,0,0|2,0,0]=4 440 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,1,0,0,0|2,0,0]=4 441 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,1,0,0,0|2,0,0]=4 442 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,1,0,0,0|2,0,0]=4 443 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,1,0,0,0|2,0,0]=4 444 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,1,0,0,0|2,0,0]=4 445 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,1,0,0,0|2,0,0]=4 446 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,1,0,0,0|2,0,0]=4 447 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,1,0,0,0|2,0,0]=4 448 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,1,0,0,0|2,0,0]=4 449 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,1,0,0,0|2,0,0]=4 450 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,1,0,0,0|2,0,0]=4 451 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,1,0,0,0|2,0,0]=4 452 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,1,0,0,0|2,0,0]=4 453 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,1,0,0,0|2,0,0]=4 454 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,1,0,0,0|1,0,1]=4 455 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,1,0,0,0|1,0,1]=4 456 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,1,0,0,0|2,0,0]=4 457 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,1,0,0,0|0,0,0]=2 458 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,1,0,0,0|1,0,0]=3 459 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,1,0,0,0|1,0,0]=3 460 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,1,0,0,0|1,0,0]=3 461 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,1,0,0,0|1,0,0]=3 462 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,1,0,0,0|0,0,1]=3 463 B9R1.15 OCc1cccnc1O 271570a_203496583355_100000748726 [1,0,1,0,0,0|1,0,1]=4 464 B9R1.15 OCc1ccncc1O 271570a_203496583355_100009873359 [1,0,1,0,0,0|1,0,1]=4 465 B9R1.15 OCc1cnccc1O 271570a_203496583355_100000117392 [1,0,1,0,0,0|1,0,1]=4 466 B9R1.15 OCc1ncccc1O 271570a_203496583355_100011996772 [1,0,1,0,0,0|1,0,1]=4 467 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,1,0,0,0|2,0,0]=4 468 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,1,0,0,0|2,0,0]=4 469 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,1,0,0,0|2,0,0]=4 470 B11R1.7 CC(C)(O[13CH3])c1ccccc1 7a_100000694644_200025704644 [0,1,1,0,0,0|1,0,1]=4 471 B11R1.7 CNS(=O)(=O)c1ccccc1 270084a_100102657272_100000210345 [0,1,1,0,0,0|2,0,0]=4 472 B11R1.7 CNS(=O)(=O)c1ccccc1 274078a_100102657272_100000210345 [0,1,1,0,0,0|2,0,0]=4 473 B11R1.7 CNS(=O)(=O)c1ccccc1 40a_100102657272_100000032697 [0,1,1,0,0,0|2,0,0]=4 474 B11R1.7 COC(C)(C)c1ccccc1 7a_100000694644_200000210301 [0,1,1,0,0,0|1,0,1]=4 475 B11R1.12 C#CC(OC)c1ccccc1 34a_100011219616_200000210301 [0,1,1,0,0,0|1,0,1]=4 476 B11R1.12 C#CC(OC)c1ccccc1 7a_100011219616_200000210301 [0,1,1,0,0,0|1,0,1]=4 477 B11R1.12 C#CC(O[13CH3])c1ccccc1 34a_100011219616_200025704644 [0,1,1,0,0,0|1,0,1]=4 478 B11R1.12 C#CC(O[13CH3])c1ccccc1 7a_100011219616_200025704644 [0,1,1,0,0,0|1,0,1]=4 479 B11R1.12 C=CC(OC)c1ccccc1 34a_100011215659_200000210301 [0,1,1,0,0,0|1,0,1]=4 480 B11R1.12 C=CC(OC)c1ccccc1 7a_100011215659_200000210301 [0,1,1,0,0,0|1,0,1]=4 481 B11R1.12 C=CC(O[13CH3])c1ccccc1 34a_100011215659_200025704644 [0,1,1,0,0,0|1,0,1]=4 482 B11R1.12 C=CC(O[13CH3])c1ccccc1 7a_100011215659_200025704644 [0,1,1,0,0,0|1,0,1]=4 483 B11R1.12 CCC(OC)c1ccccc1 34a_100000698172_200000210301 [0,1,1,0,0,0|1,0,1]=4 484 B11R1.12 CCC(OC)c1ccccc1 7a_100000698172_200000210301 [0,1,1,0,0,0|1,0,1]=4 485 B11R1.12 CCC(O[13CH3])c1ccccc1 34a_100000698172_200025704644 [0,1,1,0,0,0|1,0,1]=4 486 B11R1.12 CCC(O[13CH3])c1ccccc1 7a_100000698172_200025704644 [0,1,1,0,0,0|1,0,1]=4 487 B11R1.12 COC(C#N)c1ccccc1 7a_100011217353_200000210301 [0,1,1,0,0,0|1,0,1]=4 488 B11R1.12 COC(CBr)c1ccccc1 7a_100000185958_200000210301 [0,1,1,0,0,0|1,0,1]=4 489 B11R1.12 COC(CN)c1ccccc1 34a_100000210709_200000210301 [0,1,1,0,0,0|1,0,1]=4 490 B11R1.12 CO[C@H](CCl)c1ccccc1 34a_100011933945_200000210301 [0,1,1,0,0,0|1,0,1]=4 491 B11R1.12 CO[C@H](CCl)c1ccccc1 7a_100011933945_200000210301 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.12 [13CH3]OC(C#N)c1ccccc1 7a_100011217353_200025704644 [0,1,1,0,0,0|1,0,1]=4 493 B11R1.12 [13CH3]OC(CBr)c1ccccc1 7a_100000185958_200025704644 [0,1,1,0,0,0|1,0,1]=4 494 B11R1.12 [13CH3]OC(CN)c1ccccc1 34a_100000210709_200025704644 [0,1,1,0,0,0|1,0,1]=4 495 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 34a_100011933945_200025704644 [0,1,1,0,0,0|1,0,1]=4 496 B11R1.12 [13CH3]O[C@H](CCl)c1ccccc1 7a_100011933945_200025704644 [0,1,1,0,0,0|1,0,1]=4 497 B11R1.16 C#CCC(=O)c1ccccc1 1458a_100000185807_100000184674 [0,1,1,0,0,0|1,0,1]=4 498 B11R1.16 C=CCC(=O)c1ccccc1 1458a_100000185807_100000210623 [0,1,1,0,0,0|1,0,1]=4 499 B11R1.16 CC(CO[13CH3])c1ccccc1 34a_100011215166_200025704644 [0,1,1,0,0,0|1,0,1]=4 500 B11R1.16 CC(CO[13CH3])c1ccccc1 7a_100011215166_200025704644 [0,1,1,0,0,0|1,0,1]=4 501 B11R1.16 CCCC(=O)c1ccccc1 1458a_100000185807_100000210303 [0,1,1,0,0,0|1,0,0]=3 502 B11R1.16 CCNC(=O)c1ccccc1 11a_100015525214_100000185807 [0,1,1,0,0,0|1,0,0]=3 503 B11R1.16 CCNC(=O)c1ccccc1 240690a_100015525214_100000185807 [0,1,1,0,0,0|1,0,0]=3 504 B11R1.16 CCNC(=O)c1ccccc1 527a_100015525214_100000185807 [0,1,1,0,0,0|1,0,0]=3 505 B11R1.16 CCOC(C)c1ccccc1 34a_100121572206_100000211855 [0,1,1,0,0,0|1,0,1]=4 506 B11R1.16 CCO[C@H](C)c1ccccc1 34a_100000761318_100000210202 [0,1,1,0,0,0|1,0,1]=4 507 B11R1.16 CCO[C@H](C)c1ccccc1 7a_100000761318_100000210202 [0,1,1,0,0,0|1,0,1]=4 508 B11R1.16 CNCC(=O)c1ccccc1 7a_106832991635_100000211460 [0,1,1,0,0,0|1,0,0]=3 509 B11R1.16 CNCC(=O)c1ccccn1 34a_100102657272_100000027445 [0,1,1,0,0,0|2,0,0]=4 510 B11R1.16 CNCC(=O)c1ccccn1 7a_106832991635_100000027445 [0,1,1,0,0,0|2,0,0]=4 511 B11R1.16 CNCC(=O)c1ccncc1 7a_106832991635_100015248511 [0,1,1,0,0,0|2,0,0]=4 512 B11R1.16 CNNC(=O)c1ccccc1 22a_100016993582_100000185807 [0,1,1,0,0,0|1,0,0]=3 513 B11R1.16 COCC(=O)c1ccccn1 34a_100138415774_100000027445 [0,1,1,0,0,0|1,0,0]=3 514 B11R1.16 COCC(C)c1ccccc1 34a_100011215166_200000210301 [0,1,1,0,0,0|1,0,1]=4 515 B11R1.16 COCC(C)c1ccccc1 34a_100138415774_100000756946 [0,1,1,0,0,0|1,0,1]=4 516 B11R1.16 COCC(C)c1ccccc1 7a_100011215166_200000210301 [0,1,1,0,0,0|1,0,1]=4 517 B11R1.16 COCC(O)c1ccccc1 34a_100138415774_100000185958 [0,1,1,0,0,0|0,0,2]=4 518 B11R1.16 COCN(C)c1ccccc1 2230a_100000210012_100000766300 [0,1,1,0,0,0|2,0,0]=4 519 B11R1.16 COCN(C)c1ccccc1 269982a_100000210012_100000766300 [0,1,1,0,0,0|2,0,0]=4 520 B11R1.16 COC[C@@H](N)c1ccccc1 34a_100000751927_200000210301 [0,1,1,0,0,0|1,0,1]=4 521 B11R1.16 COC[C@@H](O)c1ccccc1 34a_100138415774_100011933945 [0,1,1,0,0,0|0,0,2]=4 522 B11R1.16 CSCC(=O)c1ccccc1 62a_100000211460_200000210301 [0,1,1,0,0,0|0,1,0]=3 523 B11R1.16 CSCC(=O)c1ccccc1 62a_200000210301_100000211460 [0,1,1,0,0,0|0,1,0]=3 524 B11R1.16 CSCC(=O)c1ccccn1 62a_100000027445_200000210301 [0,1,1,0,0,0|1,1,0]=4 525 B11R1.16 CSCC(=O)c1ccccn1 62a_200000210301_100000027445 [0,1,1,0,0,0|1,1,0]=4 526 B11R1.16 CSCC(=O)c1cccnc1 62a_100000757877_200000210301 [0,1,1,0,0,0|1,1,0]=4 527 B11R1.16 CSCC(=O)c1cccnc1 62a_200000210301_100000757877 [0,1,1,0,0,0|1,1,0]=4 528 B11R1.16 CSCC(=O)c1ccncc1 62a_100000027454_200000210301 [0,1,1,0,0,0|1,1,0]=4 529 B11R1.16 CSCC(=O)c1ccncc1 62a_200000210301_100000027454 [0,1,1,0,0,0|1,1,0]=4 530 B11R1.16 CSCS(=O)c1ccccc1 62a_200000210301_100000031784 [0,1,1,0,0,0|1,1,0]=4 531 B11R1.16 C[C@@H](OCF)c1ccccc1 34a_100000761318_100015361967 [0,1,1,0,0,0|1,0,1]=4 532 B11R1.16 C[C@@H](OCF)c1ccccc1 7a_100000761318_100015361967 [0,1,1,0,0,0|1,0,1]=4 533 B11R1.16 N#CCC(=O)c1ccccc1 1458a_100000185807_100011214920 [0,1,1,0,0,0|1,0,1]=4 534 B11R1.16 O=C(CCF)c1ccccc1 1458a_100000185807_100011217306 [0,1,1,0,0,0|1,0,0]=3 535 B11R1.16 O=C(CCO)c1ccccc1 1458a_100000185807_100000211926 [0,1,1,0,0,0|1,0,0]=3 536 B11R1.16 [13CH3]OC[C@@H](N)c1ccccc1 34a_100000751927_200025704644 [0,1,1,0,0,0|1,0,1]=4 537 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_100000211460_200025704644 [0,1,1,0,0,0|0,1,0]=3 538 B11R1.16 [13CH3]SCC(=O)c1ccccc1 62a_200025704644_100000211460 [0,1,1,0,0,0|0,1,0]=3 539 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_100000027445_200025704644 [0,1,1,0,0,0|1,1,0]=4 540 B11R1.16 [13CH3]SCC(=O)c1ccccn1 62a_200025704644_100000027445 [0,1,1,0,0,0|1,1,0]=4 541 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_100000757877_200025704644 [0,1,1,0,0,0|1,1,0]=4 542 B11R1.16 [13CH3]SCC(=O)c1cccnc1 62a_200025704644_100000757877 [0,1,1,0,0,0|1,1,0]=4 543 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_100000027454_200025704644 [0,1,1,0,0,0|1,1,0]=4 544 B11R1.16 [13CH3]SCC(=O)c1ccncc1 62a_200025704644_100000027454 [0,1,1,0,0,0|1,1,0]=4 545 B11R1.16 [13CH3]SCS(=O)c1ccccc1 62a_200025704644_100000031784 [0,1,1,0,0,0|1,1,0]=4 546 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 34a_100000745893_200025704644 [0,1,1,0,0,0|1,0,1]=4 547 B11R1.22 CC(O[13CH3])c1ccc(cc1)Br 7a_100000745893_200025704644 [0,1,1,0,0,0|1,0,1]=4 548 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 34a_100000181323_200025704644 [0,1,1,0,0,0|1,0,1]=4 549 B11R1.22 CC(O[13CH3])c1ccc(cc1)F 7a_100000181323_200025704644 [0,1,1,0,0,0|1,0,1]=4 550 B11R1.22 CC(O[13CH3])c1ccc(cc1)N 34a_100011216399_200025704644 [0,1,1,0,0,0|1,0,1]=4 551 B11R1.22 CCC(=O)c1ccc(cc1)Br 1458a_100000185839_100000210202 [0,1,1,0,0,0|1,0,0]=3 552 B11R1.22 CCC(=O)c1ccc(cc1)C 1458a_100000188618_100000210202 [0,1,1,0,0,0|1,0,0]=3 553 B11R1.22 CCC(=O)c1ccc(cc1)Cl 1458a_100000210187_100000210202 [0,1,1,0,0,0|1,0,0]=3 554 B11R1.22 CCC(=O)c1ccc(cc1)F 1458a_100000187176_100000210202 [0,1,1,0,0,0|1,0,0]=3 555 B11R1.22 CCC(=O)c1ccc(cc1)I 1458a_100000187904_100000210202 [0,1,1,0,0,0|1,0,0]=3 556 B11R1.22 CCC(=O)c1ccc(cc1)O 1458a_100000212099_100000210202 [0,1,1,0,0,0|1,0,0]=3 557 B11R1.22 CCC(=O)c1ccc(cc1)O 271570a_203496583355_100000211647 [0,1,1,0,0,0|1,0,0]=3 558 B11R1.22 CCC(=O)c1ccc(cn1)O 271570a_203496583355_100012351654 [0,1,1,0,0,0|2,0,0]=4 559 B11R1.22 CNC(=O)c1ccc(cc1)Br 11a_106832991635_100000185839 [0,1,1,0,0,0|1,0,0]=3 560 B11R1.22 CNC(=O)c1ccc(cc1)Br 1626a_100102657272_100000185839 [0,1,1,0,0,0|1,0,0]=3 561 B11R1.22 CNC(=O)c1ccc(cc1)Br 240690a_100102657272_100000185839 [0,1,1,0,0,0|1,0,0]=3 562 B11R1.22 CNC(=O)c1ccc(cc1)Br 527a_100102657272_100000185839 [0,1,1,0,0,0|1,0,0]=3 563 B11R1.22 CNC(=O)c1ccc(cc1)C 11a_106832991635_100000188618 [0,1,1,0,0,0|1,0,0]=3 564 B11R1.22 CNC(=O)c1ccc(cc1)C 1626a_100102657272_100000188618 [0,1,1,0,0,0|1,0,0]=3 565 B11R1.22 CNC(=O)c1ccc(cc1)C 240690a_100102657272_100000188618 [0,1,1,0,0,0|1,0,0]=3 566 B11R1.22 CNC(=O)c1ccc(cc1)C 527a_100102657272_100000188618 [0,1,1,0,0,0|1,0,0]=3 567 B11R1.22 CNC(=O)c1ccc(cc1)Cl 11a_106832991635_100000210187 [0,1,1,0,0,0|1,0,0]=3 568 B11R1.22 CNC(=O)c1ccc(cc1)Cl 1626a_100102657272_100000210187 [0,1,1,0,0,0|1,0,0]=3 569 B11R1.22 CNC(=O)c1ccc(cc1)Cl 240690a_100102657272_100000210187 [0,1,1,0,0,0|1,0,0]=3 570 B11R1.22 CNC(=O)c1ccc(cc1)Cl 527a_100102657272_100000210187 [0,1,1,0,0,0|1,0,0]=3 571 B11R1.22 CNC(=O)c1ccc(cc1)F 11a_106832991635_100000187176 [0,1,1,0,0,0|1,0,0]=3 572 B11R1.22 CNC(=O)c1ccc(cc1)F 1626a_100102657272_100000187176 [0,1,1,0,0,0|1,0,0]=3 573 B11R1.22 CNC(=O)c1ccc(cc1)F 240690a_100102657272_100000187176 [0,1,1,0,0,0|1,0,0]=3 574 B11R1.22 CNC(=O)c1ccc(cc1)F 527a_100102657272_100000187176 [0,1,1,0,0,0|1,0,0]=3 575 B11R1.22 CNC(=O)c1ccc(cc1)I 11a_106832991635_100000187904 [0,1,1,0,0,0|1,0,0]=3 576 B11R1.22 CNC(=O)c1ccc(cc1)I 1626a_100102657272_100000187904 [0,1,1,0,0,0|1,0,0]=3 577 B11R1.22 CNC(=O)c1ccc(cc1)I 240690a_100102657272_100000187904 [0,1,1,0,0,0|1,0,0]=3 578 B11R1.22 CNC(=O)c1ccc(cc1)I 527a_100102657272_100000187904 [0,1,1,0,0,0|1,0,0]=3 579 B11R1.22 CNC(=O)c1ccc(cc1)O 240690a_100102657272_100000212099 [0,1,1,0,0,0|1,0,0]=3 580 B11R1.22 CNC(=O)c1ccc(cc1)O 271570a_203496583355_100000155074 [0,1,1,0,0,0|1,0,0]=3 581 B11R1.22 CNC(=O)c1ccc(cc1)O 527a_100102657272_100000212099 [0,1,1,0,0,0|1,0,0]=3 582 B11R1.22 CNC(=O)c1ccc(cn1)O 271570a_203496583355_100011781262 [0,1,1,0,0,0|2,0,0]=4 583 B11R1.22 CNC(=O)c1ccc(nc1)O 271570a_203496583355_100000159860 [0,1,1,0,0,0|2,0,0]=4 584 B11R1.22 COC(=O)c1ccc(cc1)O 271570a_203496583355_100000150774 [0,1,1,0,0,0|0,0,0]=2 585 B11R1.22 COC(=O)c1ccc(cn1)O 271570a_203496583355_100000690920 [0,1,1,0,0,0|1,0,0]=3 586 B11R1.22 COC(=O)c1ccc(nc1)O 271570a_203496583355_100000733799 [0,1,1,0,0,0|1,0,0]=3 587 B11R1.22 COC(=O)c1ccc(nn1)O 271570a_203496583355_100009816182 [0,1,1,0,0,0|2,0,0]=4 588 B11R1.22 COC(=O)c1cnc(cn1)O 271570a_203496583355_100010219404 [0,1,1,0,0,0|2,0,0]=4 589 B11R1.22 COC(=O)c1cnc(nc1)O 271570a_203496583355_100000729365 [0,1,1,0,0,0|2,0,0]=4 590 B11R1.22 COC(=O)c1ncc(cn1)O 271570a_203496583355_100000690087 [0,1,1,0,0,0|2,0,0]=4 591 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100000745893_200000210301 [0,1,1,0,0,0|1,0,1]=4 592 B11R1.22 COC(C)c1ccc(cc1)Br 34a_100138415774_100000755118 [0,1,1,0,0,0|1,0,1]=4 593 B11R1.22 COC(C)c1ccc(cc1)Br 7a_100000745893_200000210301 [0,1,1,0,0,0|1,0,1]=4 594 B11R1.22 COC(C)c1ccc(cc1)C 34a_100138415774_100011261388 [0,1,1,0,0,0|1,0,1]=4 595 B11R1.22 COC(C)c1ccc(cc1)F 34a_100000181323_200000210301 [0,1,1,0,0,0|1,0,1]=4 596 B11R1.22 COC(C)c1ccc(cc1)F 34a_100138415774_100000743420 [0,1,1,0,0,0|1,0,1]=4 597 B11R1.22 COC(C)c1ccc(cc1)F 7a_100000181323_200000210301 [0,1,1,0,0,0|1,0,1]=4 598 B11R1.22 COC(C)c1ccc(cc1)N 34a_100011216399_200000210301 [0,1,1,0,0,0|1,0,1]=4 599 B11R1.22 COC(C)c1ccc(cc1)O 271570a_203496583355_100010254937 [0,1,1,0,0,0|1,0,1]=4 600 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 34a_100011852131_200000210301 [0,1,1,0,0,0|1,0,1]=4 601 B11R1.22 CO[C@@H](C)c1ccc(cc1)Cl 7a_100011852131_200000210301 [0,1,1,0,0,0|1,0,1]=4 602 B11R1.22 CO[C@H](C)c1ccc(cc1)C 34a_100000690690_200000210301 [0,1,1,0,0,0|1,0,1]=4 603 B11R1.22 CO[C@H](C)c1ccc(cc1)C 7a_100000690690_200000210301 [0,1,1,0,0,0|1,0,1]=4 604 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 34a_100011852131_200025704644 [0,1,1,0,0,0|1,0,1]=4 605 B11R1.22 C[C@H](O[13CH3])c1ccc(cc1)Cl 7a_100011852131_200025704644 [0,1,1,0,0,0|1,0,1]=4 606 B11R1.22 Cc1ccc(cc1)C(=O)CF 1458a_100000188618_100015361967 [0,1,1,0,0,0|2,0,0]=4 607 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 34a_100000690690_200025704644 [0,1,1,0,0,0|1,0,1]=4 608 B11R1.22 Cc1ccc(cc1)[C@@H](C)O[13CH3] 7a_100000690690_200025704644 [0,1,1,0,0,0|1,0,1]=4 609 B11R1.22 N#CC(=O)c1ccc(cc1)O 271570a_203496583355_100009994572 [0,1,1,0,0,0|2,0,0]=4 610 B11R1.22 NCC(=O)c1ccc(cc1)O 271570a_203496583355_100000017248 [0,1,1,0,0,0|2,0,0]=4 611 B11R1.22 NNC(=O)c1ccc(cc1)O 271570a_203496583355_100000183614 [0,1,1,0,0,0|2,0,0]=4 612 B11R1.22 O=C(CF)c1ccc(cc1)Br 1458a_100000185839_100015361967 [0,1,1,0,0,0|2,0,0]=4 613 B11R1.22 O=C(CF)c1ccc(cc1)Cl 1458a_100000210187_100015361967 [0,1,1,0,0,0|2,0,0]=4 614 B11R1.22 O=C(CF)c1ccc(cc1)F 1458a_100000187176_100015361967 [0,1,1,0,0,0|2,0,0]=4 615 B11R1.22 O=C(CF)c1ccc(cc1)I 1458a_100000187904_100015361967 [0,1,1,0,0,0|2,0,0]=4 616 B11R1.22 O=C(CF)c1ccc(cc1)O 1458a_100000212099_100015361967 [0,1,1,0,0,0|2,0,0]=4 617 B11R1.22 O=C(CO)c1ccc(cc1)O 271570a_203496583355_100011219529 [0,1,1,0,0,0|2,0,0]=4 618 B11R1.22 O=CC(=O)c1ccc(cc1)O 271570a_203496583355_100000725942 [0,1,1,0,0,0|2,0,0]=4 619 B11R1.22 [2H]C(OC)c1ccc(cc1)F 34a_217856618577_200000210301 [0,1,1,0,0,0|1,0,1]=4 620 B11R1.22 [2H]C(OC)c1ccc(cc1)F 7a_217856618577_200000210301 [0,1,1,0,0,0|1,0,1]=4 621 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 34a_217856618577_200025704644 [0,1,1,0,0,0|1,0,1]=4 622 B11R1.22 [2H]C(O[13CH3])c1ccc(cc1)F 7a_217856618577_200025704644 [0,1,1,0,0,0|1,0,1]=4 623 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 34a_100000246457_200025704644 [0,1,1,0,0,0|1,0,1]=4 624 B11R1.23 CC(O[13CH3])c1cccc(c1)Br 7a_100000246457_200025704644 [0,1,1,0,0,0|1,0,1]=4 625 B11R1.23 CC(O[13CH3])c1cccc(c1)F 34a_100000744526_200025704644 [0,1,1,0,0,0|1,0,1]=4 626 B11R1.23 CC(O[13CH3])c1cccc(c1)F 7a_100000744526_200025704644 [0,1,1,0,0,0|1,0,1]=4 627 B11R1.23 CC(O[13CH3])c1cccc(c1)I 34a_100013085317_200025704644 [0,1,1,0,0,0|1,0,1]=4 628 B11R1.23 CC(O[13CH3])c1cccc(c1)I 7a_100013085317_200025704644 [0,1,1,0,0,0|1,0,1]=4 629 B11R1.23 CC(O[13CH3])c1cccc(c1)N 34a_100011217120_200025704644 [0,1,1,0,0,0|1,0,1]=4 630 B11R1.23 CC(O[13CH3])c1cccc(c1)N 7a_100011217120_200025704644 [0,1,1,0,0,0|1,0,1]=4 631 B11R1.23 CCC(=O)c1cc(ccn1)O 271570a_203496583355_200000094848 [0,1,1,0,0,0|2,0,0]=4 632 B11R1.23 CCC(=O)c1cccc(c1)Br 1458a_100000210664_100000210202 [0,1,1,0,0,0|1,0,0]=3 633 B11R1.23 CCC(=O)c1cccc(c1)C 1458a_100000189346_100000210202 [0,1,1,0,0,0|1,0,0]=3 634 B11R1.23 CCC(=O)c1cccc(c1)Cl 1458a_100000210390_100000210202 [0,1,1,0,0,0|1,0,0]=3 635 B11R1.23 CCC(=O)c1cccc(c1)F 1458a_100000210950_100000210202 [0,1,1,0,0,0|1,0,0]=3 636 B11R1.23 CCC(=O)c1cccc(c1)I 1458a_100000184098_100000210202 [0,1,1,0,0,0|1,0,0]=3 637 B11R1.23 CCC(=O)c1cccc(c1)O 1458a_100000183914_100000210202 [0,1,1,0,0,0|1,0,0]=3 638 B11R1.23 CCC(=O)c1cccc(c1)O 271570a_203496583355_100000211677 [0,1,1,0,0,0|1,0,0]=3 639 B11R1.23 CCC(=O)c1cccc(n1)O 271570a_203496583355_100011004013 [0,1,1,0,0,0|2,0,0]=4 640 B11R1.23 CNC(=O)c1cc(ccn1)O 271570a_203496583355_100000204654 [0,1,1,0,0,0|2,0,0]=4 641 B11R1.23 CNC(=O)c1cccc(c1)Br 11a_106832991635_100000210664 [0,1,1,0,0,0|1,0,0]=3 642 B11R1.23 CNC(=O)c1cccc(c1)Br 1626a_100102657272_100000210664 [0,1,1,0,0,0|1,0,0]=3 643 B11R1.23 CNC(=O)c1cccc(c1)Br 240690a_100102657272_100000210664 [0,1,1,0,0,0|1,0,0]=3 644 B11R1.23 CNC(=O)c1cccc(c1)Br 527a_100102657272_100000210664 [0,1,1,0,0,0|1,0,0]=3 645 B11R1.23 CNC(=O)c1cccc(c1)C 11a_106832991635_100000189346 [0,1,1,0,0,0|1,0,0]=3 646 B11R1.23 CNC(=O)c1cccc(c1)C 1626a_100102657272_100000189346 [0,1,1,0,0,0|1,0,0]=3 647 B11R1.23 CNC(=O)c1cccc(c1)C 240690a_100102657272_100000189346 [0,1,1,0,0,0|1,0,0]=3 648 B11R1.23 CNC(=O)c1cccc(c1)C 527a_100102657272_100000189346 [0,1,1,0,0,0|1,0,0]=3 649 B11R1.23 CNC(=O)c1cccc(c1)Cl 11a_106832991635_100000210390 [0,1,1,0,0,0|1,0,0]=3 650 B11R1.23 CNC(=O)c1cccc(c1)Cl 1626a_100102657272_100000210390 [0,1,1,0,0,0|1,0,0]=3 651 B11R1.23 CNC(=O)c1cccc(c1)Cl 240690a_100102657272_100000210390 [0,1,1,0,0,0|1,0,0]=3 652 B11R1.23 CNC(=O)c1cccc(c1)Cl 527a_100102657272_100000210390 [0,1,1,0,0,0|1,0,0]=3 653 B11R1.23 CNC(=O)c1cccc(c1)F 11a_106832991635_100000210950 [0,1,1,0,0,0|1,0,0]=3 654 B11R1.23 CNC(=O)c1cccc(c1)F 1626a_100102657272_100000210950 [0,1,1,0,0,0|1,0,0]=3 655 B11R1.23 CNC(=O)c1cccc(c1)F 240690a_100102657272_100000210950 [0,1,1,0,0,0|1,0,0]=3 656 B11R1.23 CNC(=O)c1cccc(c1)F 527a_100102657272_100000210950 [0,1,1,0,0,0|1,0,0]=3 657 B11R1.23 CNC(=O)c1cccc(c1)I 11a_106832991635_100000184098 [0,1,1,0,0,0|1,0,0]=3 658 B11R1.23 CNC(=O)c1cccc(c1)I 1626a_100102657272_100000184098 [0,1,1,0,0,0|1,0,0]=3 659 B11R1.23 CNC(=O)c1cccc(c1)I 240690a_100102657272_100000184098 [0,1,1,0,0,0|1,0,0]=3 660 B11R1.23 CNC(=O)c1cccc(c1)I 527a_100102657272_100000184098 [0,1,1,0,0,0|1,0,0]=3 661 B11R1.23 CNC(=O)c1cccc(c1)O 240690a_100102657272_100000183914 [0,1,1,0,0,0|1,0,0]=3 662 B11R1.23 CNC(=O)c1cccc(c1)O 271570a_203496583355_100000155082 [0,1,1,0,0,0|1,0,0]=3 663 B11R1.23 CNC(=O)c1cccc(c1)O 527a_100102657272_100000183914 [0,1,1,0,0,0|1,0,0]=3 664 B11R1.23 CNC(=O)c1cccc(n1)O 271570a_203496583355_100000755456 [0,1,1,0,0,0|2,0,0]=4 665 B11R1.23 CNC(=O)c1ccnc(c1)O 271570a_203496583355_100011196506 [0,1,1,0,0,0|2,0,0]=4 666 B11R1.23 CNC(=O)c1cncc(c1)O 271570a_203496583355_200000155086 [0,1,1,0,0,0|2,0,0]=4 667 B11R1.23 COC(=O)c1cc(ccn1)O 271570a_203496583355_100000693414 [0,1,1,0,0,0|1,0,0]=3 668 B11R1.23 COC(=O)c1cc(ncn1)O 271570a_203496583355_100000051410 [0,1,1,0,0,0|2,0,0]=4 669 B11R1.23 COC(=O)c1cccc(c1)O 271570a_203496583355_100000148679 [0,1,1,0,0,0|0,0,0]=2 670 B11R1.23 COC(=O)c1cccc(n1)O 271570a_203496583355_100000708286 [0,1,1,0,0,0|1,0,0]=3 671 B11R1.23 COC(=O)c1ccnc(c1)O 271570a_203496583355_100011934382 [0,1,1,0,0,0|1,0,0]=3 672 B11R1.23 COC(=O)c1ccnc(n1)O 271570a_203496583355_100000070389 [0,1,1,0,0,0|2,0,0]=4 673 B11R1.23 COC(=O)c1cncc(c1)O 271570a_203496583355_100000148912 [0,1,1,0,0,0|1,0,0]=3 674 B11R1.23 COC(=O)c1cncc(n1)O 271570a_203496583355_100000765340 [0,1,1,0,0,0|2,0,0]=4 675 B11R1.23 COC(=O)c1cnnc(c1)O 271570a_203496583355_100009862058 [0,1,1,0,0,0|2,0,0]=4 676 B11R1.23 COC(C)c1cccc(c1)Br 34a_100000246457_200000210301 [0,1,1,0,0,0|1,0,1]=4 677 B11R1.23 COC(C)c1cccc(c1)Br 7a_100000246457_200000210301 [0,1,1,0,0,0|1,0,1]=4 678 B11R1.23 COC(C)c1cccc(c1)C 34a_100000757818_200000210301 [0,1,1,0,0,0|1,0,1]=4 679 B11R1.23 COC(C)c1cccc(c1)C 7a_100000757818_200000210301 [0,1,1,0,0,0|1,0,1]=4 680 B11R1.23 COC(C)c1cccc(c1)F 34a_100000744526_200000210301 [0,1,1,0,0,0|1,0,1]=4 681 B11R1.23 COC(C)c1cccc(c1)F 7a_100000744526_200000210301 [0,1,1,0,0,0|1,0,1]=4 682 B11R1.23 COC(C)c1cccc(c1)I 34a_100013085317_200000210301 [0,1,1,0,0,0|1,0,1]=4 683 B11R1.23 COC(C)c1cccc(c1)I 7a_100013085317_200000210301 [0,1,1,0,0,0|1,0,1]=4 684 B11R1.23 COC(C)c1cccc(c1)N 34a_100011217120_200000210301 [0,1,1,0,0,0|1,0,1]=4 685 B11R1.23 COC(C)c1cccc(c1)N 7a_100011217120_200000210301 [0,1,1,0,0,0|1,0,1]=4 686 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 34a_100000747380_200000210301 [0,1,1,0,0,0|1,0,1]=4 687 B11R1.23 CO[C@H](C)c1cccc(c1)Cl 7a_100000747380_200000210301 [0,1,1,0,0,0|1,0,1]=4 688 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 34a_100000747380_200025704644 [0,1,1,0,0,0|1,0,1]=4 689 B11R1.23 C[C@@H](O[13CH3])c1cccc(c1)Cl 7a_100000747380_200025704644 [0,1,1,0,0,0|1,0,1]=4 690 B11R1.23 Cc1cccc(c1)C(=O)CF 1458a_100000189346_100015361967 [0,1,1,0,0,0|2,0,0]=4 691 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 34a_100000757818_200025704644 [0,1,1,0,0,0|1,0,1]=4 692 B11R1.23 Cc1cccc(c1)C(C)O[13CH3] 7a_100000757818_200025704644 [0,1,1,0,0,0|1,0,1]=4 693 B11R1.23 N#CC(=O)c1cccc(c1)O 271570a_203496583355_100010169886 [0,1,1,0,0,0|2,0,0]=4 694 B11R1.23 NCC(=O)c1cccc(c1)O 271570a_203496583355_100020587001 [0,1,1,0,0,0|2,0,0]=4 695 B11R1.23 NNC(=O)c1cccc(c1)O 271570a_203496583355_100000189783 [0,1,1,0,0,0|2,0,0]=4 696 B11R1.23 O=C(CF)c1cccc(c1)Br 1458a_100000210664_100015361967 [0,1,1,0,0,0|2,0,0]=4 697 B11R1.23 O=C(CF)c1cccc(c1)Cl 1458a_100000210390_100015361967 [0,1,1,0,0,0|2,0,0]=4 698 B11R1.23 O=C(CF)c1cccc(c1)F 1458a_100000210950_100015361967 [0,1,1,0,0,0|2,0,0]=4 699 B11R1.23 O=C(CF)c1cccc(c1)I 1458a_100000184098_100015361967 [0,1,1,0,0,0|2,0,0]=4 700 B11R1.23 O=C(CF)c1cccc(c1)O 1458a_100000183914_100015361967 [0,1,1,0,0,0|2,0,0]=4 701 B11R1.23 O=CC(=O)c1cccc(c1)O 271570a_203496583355_100000726164 [0,1,1,0,0,0|2,0,0]=4 702 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,1,1,0,0,0|2,0,0]=4 703 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,1,1,0,0,0|2,0,0]=4 704 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,1,1,0,0,0|2,0,0]=4 705 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,1,1,0,0,0|1,0,0]=3 706 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,1,1,0,0,0|1,0,0]=3 707 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,1,1,0,0,0|1,0,0]=3 708 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,1,1,0,0,0|1,0,0]=3 709 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,1,1,0,0,0|1,0,0]=3 710 B11R1.222 CC(O[13CH3])c1ccccc1Br 34a_100000702211_200025704644 [0,1,1,0,0,0|1,0,1]=4 711 B11R1.222 CC(O[13CH3])c1ccccc1Br 7a_100000702211_200025704644 [0,1,1,0,0,0|1,0,1]=4 712 B11R1.222 CC(O[13CH3])c1ccccc1Cl 34a_100000740796_200025704644 [0,1,1,0,0,0|1,0,1]=4 713 B11R1.222 CC(O[13CH3])c1ccccc1Cl 7a_100000740796_200025704644 [0,1,1,0,0,0|1,0,1]=4 714 B11R1.222 CC(O[13CH3])c1ccccc1F 34a_100000697922_200025704644 [0,1,1,0,0,0|1,0,1]=4 715 B11R1.222 CC(O[13CH3])c1ccccc1F 7a_100000697922_200025704644 [0,1,1,0,0,0|1,0,1]=4 716 B11R1.222 CC(O[13CH3])c1ccccc1N 7a_100011405641_200025704644 [0,1,1,0,0,0|1,0,1]=4 717 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [0,1,1,0,0,0|1,0,0]=3 718 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [0,1,1,0,0,0|1,0,0]=3 719 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [0,1,1,0,0,0|1,0,0]=3 720 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [0,1,1,0,0,0|1,0,0]=3 721 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [0,1,1,0,0,0|1,0,0]=3 722 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [0,1,1,0,0,0|1,0,0]=3 723 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [0,1,1,0,0,0|1,0,0]=3 724 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [0,1,1,0,0,0|1,0,0]=3 725 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [0,1,1,0,0,0|1,0,0]=3 726 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [0,1,1,0,0,0|1,0,0]=3 727 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [0,1,1,0,0,0|1,0,0]=3 728 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [0,1,1,0,0,0|1,0,0]=3 729 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [0,1,1,0,0,0|1,0,0]=3 730 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [0,1,1,0,0,0|1,0,0]=3 731 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [0,1,1,0,0,0|1,0,0]=3 732 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [0,1,1,0,0,0|1,0,0]=3 733 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [0,1,1,0,0,0|1,0,0]=3 734 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [0,1,1,0,0,0|1,0,0]=3 735 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [0,1,1,0,0,0|1,0,0]=3 736 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [0,1,1,0,0,0|1,0,0]=3 737 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [0,1,1,0,0,0|1,0,0]=3 738 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [0,1,1,0,0,0|1,0,0]=3 739 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [0,1,1,0,0,0|1,0,0]=3 740 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [0,1,1,0,0,0|1,0,0]=3 741 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [0,1,1,0,0,0|1,0,0]=3 742 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [0,1,1,0,0,0|1,0,0]=3 743 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [0,1,1,0,0,0|1,0,0]=3 744 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [0,1,1,0,0,0|1,0,0]=3 745 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [0,1,1,0,0,0|1,0,0]=3 746 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [0,1,1,0,0,0|1,0,0]=3 747 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [0,1,1,0,0,0|1,0,0]=3 748 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [0,1,1,0,0,0|1,0,0]=3 749 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [0,1,1,0,0,0|2,0,0]=4 750 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [0,1,1,0,0,0|0,0,0]=2 751 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [0,1,1,0,0,0|1,0,0]=3 752 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [0,1,1,0,0,0|1,0,0]=3 753 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [0,1,1,0,0,0|1,0,0]=3 754 B11R1.222 COC(=O)c1cncnc1O 271570a_203496583355_100000726419 [0,1,1,0,0,0|2,0,0]=4 755 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [0,1,1,0,0,0|1,0,0]=3 756 B11R1.222 COC(=O)c1nccnc1O 271570a_203496583355_100000688410 [0,1,1,0,0,0|2,0,0]=4 757 B11R1.222 COC(=O)c1ncncc1O 271570a_203496583355_100012360100 [0,1,1,0,0,0|2,0,0]=4 758 B11R1.222 COC(C)c1ccccc1Br 34a_100000702211_200000210301 [0,1,1,0,0,0|1,0,1]=4 759 B11R1.222 COC(C)c1ccccc1Br 7a_100000702211_200000210301 [0,1,1,0,0,0|1,0,1]=4 760 B11R1.222 COC(C)c1ccccc1C 34a_100000742021_200000210301 [0,1,1,0,0,0|1,0,1]=4 761 B11R1.222 COC(C)c1ccccc1C 7a_100000742021_200000210301 [0,1,1,0,0,0|1,0,1]=4 762 B11R1.222 COC(C)c1ccccc1Cl 34a_100000740796_200000210301 [0,1,1,0,0,0|1,0,1]=4 763 B11R1.222 COC(C)c1ccccc1Cl 7a_100000740796_200000210301 [0,1,1,0,0,0|1,0,1]=4 764 B11R1.222 COC(C)c1ccccc1F 34a_100000697922_200000210301 [0,1,1,0,0,0|1,0,1]=4 765 B11R1.222 COC(C)c1ccccc1F 34a_100138415774_200000741388 [0,1,1,0,0,0|1,0,1]=4 766 B11R1.222 COC(C)c1ccccc1F 7a_100000697922_200000210301 [0,1,1,0,0,0|1,0,1]=4 767 B11R1.222 COC(C)c1ccccc1N 7a_100011405641_200000210301 [0,1,1,0,0,0|1,0,1]=4 768 B11R1.222 Cc1ccccc1C(=O)CF 1458a_100000212026_100015361967 [0,1,1,0,0,0|2,0,0]=4 769 B11R1.222 Cc1ccccc1C(C)O[13CH3] 34a_100000742021_200025704644 [0,1,1,0,0,0|1,0,1]=4 770 B11R1.222 Cc1ccccc1C(C)O[13CH3] 7a_100000742021_200025704644 [0,1,1,0,0,0|1,0,1]=4 771 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [0,1,1,0,0,0|2,0,0]=4 772 B11R1.222 O=C(CF)c1ccccc1Br 1458a_100000188424_100015361967 [0,1,1,0,0,0|2,0,0]=4 773 B11R1.222 O=C(CF)c1ccccc1Cl 1458a_100000185844_100015361967 [0,1,1,0,0,0|2,0,0]=4 774 B11R1.222 O=C(CF)c1ccccc1F 1458a_100000188656_100015361967 [0,1,1,0,0,0|2,0,0]=4 775 B11R1.222 O=C(CF)c1ccccc1I 1458a_100000187884_100015361967 [0,1,1,0,0,0|2,0,0]=4 776 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [0,1,1,0,0,0|2,0,0]=4 777 B11R1.222 O=C(CF)c1ccccc1[O-] 1458a_100009911694_100015361967 [0,1,1,0,0,0|2,0,0]=4 778 B11R1.27 C=CCOCC1=CC(=O)OC1 34a_200000210373_100000716558 [0,1,1,0,0,0|0,0,2]=4 779 B11R1.27 C=CCSCC1=CC(=O)OC1 62a_100000210623_100000716558 [0,1,1,0,0,0|0,0,2]=4 780 B11R1.27 C=CCSCC1=CC(=O)OC1 62a_100000716558_100000210623 [0,1,1,0,0,0|0,0,2]=4 781 B11R1.1 CCOCc1ccc(cc1)Br 34a_100000695286_100000210202 [0,1,1,0,0,0|1,0,1]=4 782 B11R1.1 CCOCc1ccc(cc1)Br 34a_100121572206_100000189115 [0,1,1,0,0,0|1,0,1]=4 783 B11R1.1 CCOCc1ccc(cc1)C 34a_100011215236_100000210202 [0,1,1,0,0,0|1,0,1]=4 784 B11R1.1 CCOCc1ccc(cc1)C 34a_100121572206_100000210814 [0,1,1,0,0,0|1,0,1]=4 785 B11R1.1 CCOCc1ccc(cc1)C 7a_100011215236_100000210202 [0,1,1,0,0,0|1,0,1]=4 786 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100000211118_100000210202 [0,1,1,0,0,0|1,0,1]=4 787 B11R1.1 CCOCc1ccc(cc1)Cl 34a_100121572206_100000694040 [0,1,1,0,0,0|1,0,1]=4 788 B11R1.1 CCOCc1ccc(cc1)Cl 7a_100000211118_100000210202 [0,1,1,0,0,0|1,0,1]=4 789 B11R1.1 CCOCc1ccc(cc1)F 34a_100000210977_100000210202 [0,1,1,0,0,0|1,0,1]=4 790 B11R1.1 CCOCc1ccc(cc1)F 34a_100121572206_100000198546 [0,1,1,0,0,0|1,0,1]=4 791 B11R1.1 CCOCc1ccc(cc1)F 7a_100000210977_100000210202 [0,1,1,0,0,0|1,0,1]=4 792 B11R1.1 CCOCc1ccc(cc1)I 34a_100000690907_100000210202 [0,1,1,0,0,0|1,0,1]=4 793 B11R1.1 CCOCc1ccc(cc1)I 34a_100121572206_100000189116 [0,1,1,0,0,0|1,0,1]=4 794 B11R1.1 CCOCc1ccc(cc1)I 7a_100000690907_100000210202 [0,1,1,0,0,0|1,0,1]=4 795 B11R1.1 CCOCc1ccc(cc1)N 34a_100011215238_100000210202 [0,1,1,0,0,0|1,0,1]=4 796 B11R1.1 CCOCc1ccc(cc1)O 271570a_203496583355_100000758564 [0,1,1,0,0,0|1,0,1]=4 797 B11R1.1 Cc1ccc(cc1)COCF 34a_100011215236_100015361967 [0,1,1,0,0,0|1,0,1]=4 798 B11R1.1 Cc1ccc(cc1)COCF 7a_100011215236_100015361967 [0,1,1,0,0,0|1,0,1]=4 799 B11R1.1 Cc1ccc(cc1)NCC=O 34a_100000124888_200009817547 [0,1,1,0,0,0|2,0,0]=4 800 B11R1.1 Cc1ccc(cc1)OCC=O 34a_100000210336_200009817547 [0,1,1,0,0,0|2,0,0]=4 801 B11R1.1 Cc1ccc(cc1)OCC=O 7a_100000210336_200015260668 [0,1,1,0,0,0|2,0,0]=4 802 B11R1.1 Cc1ccc(cc1)SCC=O 62a_100000186775_200015260668 [0,1,1,0,0,0|2,0,0]=4 803 B11R1.1 Cc1ccc(cc1)SCC=O 62a_200015260668_100000186775 [0,1,1,0,0,0|2,0,0]=4 804 B11R1.1 FCOCc1ccc(cc1)Br 34a_100000695286_100015361967 [0,1,1,0,0,0|1,0,1]=4 805 B11R1.1 FCOCc1ccc(cc1)Cl 34a_100000211118_100015361967 [0,1,1,0,0,0|1,0,1]=4 806 B11R1.1 FCOCc1ccc(cc1)Cl 7a_100000211118_100015361967 [0,1,1,0,0,0|1,0,1]=4 807 B11R1.1 FCOCc1ccc(cc1)F 34a_100000210977_100015361967 [0,1,1,0,0,0|1,0,1]=4 808 B11R1.1 FCOCc1ccc(cc1)F 7a_100000210977_100015361967 [0,1,1,0,0,0|1,0,1]=4 809 B11R1.1 FCOCc1ccc(cc1)I 34a_100000690907_100015361967 [0,1,1,0,0,0|1,0,1]=4 810 B11R1.1 FCOCc1ccc(cc1)I 7a_100000690907_100015361967 [0,1,1,0,0,0|1,0,1]=4 811 B11R1.1 Nc1ccc(cc1)COCF 34a_100011215238_100015361967 [0,1,1,0,0,0|1,0,1]=4 812 B11R1.1 Nc1ccc(cc1)OCC=O 34a_100000185829_200009817547 [0,1,1,0,0,0|2,0,0]=4 813 B11R1.1 Nc1ccc(cc1)SCC=O 62a_100000185761_200015260668 [0,1,1,0,0,0|2,0,0]=4 814 B11R1.1 Nc1ccc(cc1)SCC=O 62a_200015260668_100000185761 [0,1,1,0,0,0|2,0,0]=4 815 B11R1.1 O=CCCc1ccc(cc1)O 271570a_203496583355_100011361538 [0,1,1,0,0,0|1,0,0]=3 816 B11R1.1 O=CCNc1ccc(cc1)Br 2230a_100000210018_200015260668 [0,1,1,0,0,0|2,0,0]=4 817 B11R1.1 O=CCNc1ccc(cc1)Br 34a_100000210018_200009817547 [0,1,1,0,0,0|2,0,0]=4 818 B11R1.1 O=CCNc1ccc(cc1)Cl 2230a_100000210052_200015260668 [0,1,1,0,0,0|2,0,0]=4 819 B11R1.1 O=CCNc1ccc(cc1)Cl 34a_100000210052_200009817547 [0,1,1,0,0,0|2,0,0]=4 820 B11R1.1 O=CCNc1ccc(cc1)F 34a_100000185862_200009817547 [0,1,1,0,0,0|2,0,0]=4 821 B11R1.1 O=CCNc1ccc(cc1)I 34a_100000185761_200009817547 [0,1,1,0,0,0|2,0,0]=4 822 B11R1.1 O=CCNc1ccc(cc1)O 34a_100000185829_200009817547 [0,1,1,0,0,0|2,0,0]=4 823 B11R1.1 O=CCOc1ccc(cc1)Br 34a_100000185759_200009817547 [0,1,1,0,0,0|2,0,0]=4 824 B11R1.1 O=CCOc1ccc(cc1)Br 7a_100000185759_200015260668 [0,1,1,0,0,0|2,0,0]=4 825 B11R1.1 O=CCOc1ccc(cc1)Cl 34a_100000210216_200009817547 [0,1,1,0,0,0|2,0,0]=4 826 B11R1.1 O=CCOc1ccc(cc1)Cl 7a_100000210216_200015260668 [0,1,1,0,0,0|2,0,0]=4 827 B11R1.1 O=CCOc1ccc(cc1)F 34a_100000210339_200009817547 [0,1,1,0,0,0|2,0,0]=4 828 B11R1.1 O=CCOc1ccc(cc1)I 34a_100000212066_200009817547 [0,1,1,0,0,0|2,0,0]=4 829 B11R1.1 O=CCOc1ccc(cc1)I 7a_100000212066_200015260668 [0,1,1,0,0,0|2,0,0]=4 830 B11R1.1 O=CCSc1ccc(cc1)Br 62a_100000752885_200015260668 [0,1,1,0,0,0|2,0,0]=4 831 B11R1.1 O=CCSc1ccc(cc1)Br 62a_200015260668_100000752885 [0,1,1,0,0,0|2,0,0]=4 832 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_100000755918_200015260668 [0,1,1,0,0,0|2,0,0]=4 833 B11R1.1 O=CCSc1ccc(cc1)Cl 62a_200015260668_100000755918 [0,1,1,0,0,0|2,0,0]=4 834 B11R1.1 O=CCSc1ccc(cc1)F 62a_100000211213_200015260668 [0,1,1,0,0,0|2,0,0]=4 835 B11R1.1 O=CCSc1ccc(cc1)F 62a_200015260668_100000211213 [0,1,1,0,0,0|2,0,0]=4 836 B11R1.1 O=CCSc1ccc(cc1)O 62a_200015260668_100000185759 [0,1,1,0,0,0|2,0,0]=4 837 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [0,1,1,0,0,0|1,0,1]=4 838 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [0,1,1,0,0,0|1,0,1]=4 839 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [0,1,1,0,0,0|1,0,1]=4 840 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [0,1,1,0,0,0|1,0,1]=4 841 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [0,1,1,0,0,0|1,0,1]=4 842 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [0,1,1,0,0,0|1,0,1]=4 843 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [0,1,1,0,0,0|1,0,1]=4 844 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [0,1,1,0,0,0|1,0,1]=4 845 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [0,1,1,0,0,0|1,0,1]=4 846 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [0,1,1,0,0,0|1,0,1]=4 847 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [0,1,1,0,0,0|1,0,1]=4 848 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [0,1,1,0,0,0|1,0,1]=4 849 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 850 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [0,1,1,0,0,0|1,0,1]=4 851 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 852 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [0,1,1,0,0,0|1,0,1]=4 853 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [0,1,1,0,0,0|1,0,1]=4 854 B11R1.17 Cc1ccccc1COCF 34a_100000698903_100015361967 [0,1,1,0,0,0|1,0,1]=4 855 B11R1.17 Cc1ccccc1COCF 7a_100000698903_100015361967 [0,1,1,0,0,0|1,0,1]=4 856 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,1,1,0,0,0|2,0,0]=4 857 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,1,1,0,0,0|2,0,0]=4 858 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,1,1,0,0,0|2,0,0]=4 859 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,1,1,0,0,0|2,0,0]=4 860 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,1,1,0,0,0|2,0,0]=4 861 B11R1.17 FCOCc1ccccc1Br 34a_100000756307_100015361967 [0,1,1,0,0,0|1,0,1]=4 862 B11R1.17 FCOCc1ccccc1Br 7a_100000756307_100015361967 [0,1,1,0,0,0|1,0,1]=4 863 B11R1.17 FCOCc1ccccc1Cl 34a_100000210847_100015361967 [0,1,1,0,0,0|1,0,1]=4 864 B11R1.17 FCOCc1ccccc1Cl 7a_100000210847_100015361967 [0,1,1,0,0,0|1,0,1]=4 865 B11R1.17 FCOCc1ccccc1F 34a_100000211962_100015361967 [0,1,1,0,0,0|1,0,1]=4 866 B11R1.17 FCOCc1ccccc1F 7a_100000211962_100015361967 [0,1,1,0,0,0|1,0,1]=4 867 B11R1.17 FCOCc1ccccc1I 34a_100000187465_100015361967 [0,1,1,0,0,0|1,0,1]=4 868 B11R1.17 FCOCc1ccccc1I 7a_100000187465_100015361967 [0,1,1,0,0,0|1,0,1]=4 869 B11R1.17 Nc1ccccc1COCF 34a_100000212039_100015361967 [0,1,1,0,0,0|1,0,1]=4 870 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,1,0,0,0|2,0,0]=4 871 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,1,0,0,0|2,0,0]=4 872 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [0,1,1,0,0,0|2,0,0]=4 873 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [0,1,1,0,0,0|2,0,0]=4 874 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,1,1,0,0,0|1,0,0]=3 875 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [0,1,1,0,0,0|2,0,0]=4 876 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [0,1,1,0,0,0|2,0,0]=4 877 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [0,1,1,0,0,0|2,0,0]=4 878 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [0,1,1,0,0,0|2,0,0]=4 879 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,1,1,0,0,0|2,0,0]=4 880 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,1,1,0,0,0|2,0,0]=4 881 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,1,1,0,0,0|2,0,0]=4 882 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,1,1,0,0,0|2,0,0]=4 883 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,1,1,0,0,0|2,0,0]=4 884 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,1,1,0,0,0|2,0,0]=4 885 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,1,1,0,0,0|2,0,0]=4 886 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,1,1,0,0,0|2,0,0]=4 887 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,1,1,0,0,0|2,0,0]=4 888 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [0,1,1,0,0,0|2,0,0]=4 889 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [0,1,1,0,0,0|2,0,0]=4 890 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [0,1,1,0,0,0|2,0,0]=4 891 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [0,1,1,0,0,0|2,0,0]=4 892 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [0,1,1,0,0,0|2,0,0]=4 893 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [0,1,1,0,0,0|2,0,0]=4 894 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,1,1,0,0,0|2,0,0]=4 895 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,1,1,0,0,0|2,0,0]=4 896 B11R1.24 CCOCc1cccc(c1)Br 34a_100000687537_100000210202 [0,1,1,0,0,0|1,0,1]=4 897 B11R1.24 CCOCc1cccc(c1)Br 34a_100121572206_100000698116 [0,1,1,0,0,0|1,0,1]=4 898 B11R1.24 CCOCc1cccc(c1)Br 7a_100000687537_100000210202 [0,1,1,0,0,0|1,0,1]=4 899 B11R1.24 CCOCc1cccc(c1)C 34a_100011217746_100000210202 [0,1,1,0,0,0|1,0,1]=4 900 B11R1.24 CCOCc1cccc(c1)C 34a_100121572206_100000211840 [0,1,1,0,0,0|1,0,1]=4 901 B11R1.24 CCOCc1cccc(c1)C 7a_100011217746_100000210202 [0,1,1,0,0,0|1,0,1]=4 902 B11R1.24 CCOCc1cccc(c1)Cl 34a_100000241301_100000210202 [0,1,1,0,0,0|1,0,1]=4 903 B11R1.24 CCOCc1cccc(c1)Cl 34a_100121572206_100000187163 [0,1,1,0,0,0|1,0,1]=4 904 B11R1.24 CCOCc1cccc(c1)Cl 7a_100000241301_100000210202 [0,1,1,0,0,0|1,0,1]=4 905 B11R1.24 CCOCc1cccc(c1)F 34a_100000210976_100000210202 [0,1,1,0,0,0|1,0,1]=4 906 B11R1.24 CCOCc1cccc(c1)F 34a_100121572206_100000187166 [0,1,1,0,0,0|1,0,1]=4 907 B11R1.24 CCOCc1cccc(c1)F 7a_100000210976_100000210202 [0,1,1,0,0,0|1,0,1]=4 908 B11R1.24 CCOCc1cccc(c1)I 34a_100011215336_100000210202 [0,1,1,0,0,0|1,0,1]=4 909 B11R1.24 CCOCc1cccc(c1)I 34a_100121572206_100011218688 [0,1,1,0,0,0|1,0,1]=4 910 B11R1.24 CCOCc1cccc(c1)I 7a_100011215336_100000210202 [0,1,1,0,0,0|1,0,1]=4 911 B11R1.24 CCOCc1cccc(c1)N 34a_100000211919_100000210202 [0,1,1,0,0,0|1,0,1]=4 912 B11R1.24 CCOCc1cccc(c1)O 271570a_203496583355_100011493694 [0,1,1,0,0,0|1,0,1]=4 913 B11R1.24 CCOCc1cccc(c1)O 34a_100121572206_100011660834 [0,1,1,0,0,0|1,0,1]=4 914 B11R1.24 Cc1cccc(c1)COCF 34a_100011217746_100015361967 [0,1,1,0,0,0|1,0,1]=4 915 B11R1.24 Cc1cccc(c1)COCF 7a_100011217746_100015361967 [0,1,1,0,0,0|1,0,1]=4 916 B11R1.24 Cc1cccc(c1)NCC=O 2230a_100000188690_200015260668 [0,1,1,0,0,0|2,0,0]=4 917 B11R1.24 Cc1cccc(c1)NCC=O 34a_100000188690_200009817547 [0,1,1,0,0,0|2,0,0]=4 918 B11R1.24 Cc1cccc(c1)OCC=O 34a_100000210337_200009817547 [0,1,1,0,0,0|2,0,0]=4 919 B11R1.24 Cc1cccc(c1)OCC=O 7a_100000210337_200015260668 [0,1,1,0,0,0|2,0,0]=4 920 B11R1.24 Cc1cccc(c1)SCC=O 62a_100011215228_200015260668 [0,1,1,0,0,0|2,0,0]=4 921 B11R1.24 Cc1cccc(c1)SCC=O 62a_200015260668_100011215228 [0,1,1,0,0,0|2,0,0]=4 922 B11R1.24 FCOCc1cccc(c1)Br 34a_100000687537_100015361967 [0,1,1,0,0,0|1,0,1]=4 923 B11R1.24 FCOCc1cccc(c1)Br 7a_100000687537_100015361967 [0,1,1,0,0,0|1,0,1]=4 924 B11R1.24 FCOCc1cccc(c1)Cl 34a_100000241301_100015361967 [0,1,1,0,0,0|1,0,1]=4 925 B11R1.24 FCOCc1cccc(c1)Cl 7a_100000241301_100015361967 [0,1,1,0,0,0|1,0,1]=4 926 B11R1.24 FCOCc1cccc(c1)F 34a_100000210976_100015361967 [0,1,1,0,0,0|1,0,1]=4 927 B11R1.24 FCOCc1cccc(c1)F 7a_100000210976_100015361967 [0,1,1,0,0,0|1,0,1]=4 928 B11R1.24 FCOCc1cccc(c1)I 34a_100011215336_100015361967 [0,1,1,0,0,0|1,0,1]=4 929 B11R1.24 FCOCc1cccc(c1)I 7a_100011215336_100015361967 [0,1,1,0,0,0|1,0,1]=4 930 B11R1.24 Nc1cccc(c1)COCF 34a_100000211919_100015361967 [0,1,1,0,0,0|1,0,1]=4 931 B11R1.24 Nc1cccc(c1)OCC=O 34a_100000210217_200009817547 [0,1,1,0,0,0|2,0,0]=4 932 B11R1.24 Nc1cccc(c1)SCC=O 62a_100000210019_200015260668 [0,1,1,0,0,0|2,0,0]=4 933 B11R1.24 Nc1cccc(c1)SCC=O 62a_200015260668_100000210019 [0,1,1,0,0,0|2,0,0]=4 934 B11R1.24 O=CCNc1cccc(c1)Br 34a_100000210019_200009817547 [0,1,1,0,0,0|2,0,0]=4 935 B11R1.24 O=CCNc1cccc(c1)Cl 34a_100000185859_200009817547 [0,1,1,0,0,0|2,0,0]=4 936 B11R1.24 O=CCNc1cccc(c1)F 34a_100000210047_200009817547 [0,1,1,0,0,0|2,0,0]=4 937 B11R1.24 O=CCNc1cccc(c1)I 34a_100000211102_200009817547 [0,1,1,0,0,0|2,0,0]=4 938 B11R1.24 O=CCNc1cccc(c1)O 34a_100000210217_200009817547 [0,1,1,0,0,0|2,0,0]=4 939 B11R1.24 O=CCOc1cccc(c1)Br 34a_100000210342_200009817547 [0,1,1,0,0,0|2,0,0]=4 940 B11R1.24 O=CCOc1cccc(c1)Br 7a_100000210342_200015260668 [0,1,1,0,0,0|2,0,0]=4 941 B11R1.24 O=CCOc1cccc(c1)Cl 34a_100000210295_200009817547 [0,1,1,0,0,0|2,0,0]=4 942 B11R1.24 O=CCOc1cccc(c1)Cl 7a_100000210295_200015260668 [0,1,1,0,0,0|2,0,0]=4 943 B11R1.24 O=CCOc1cccc(c1)F 34a_100000210426_200009817547 [0,1,1,0,0,0|2,0,0]=4 944 B11R1.24 O=CCOc1cccc(c1)F 7a_100000210426_200015260668 [0,1,1,0,0,0|2,0,0]=4 945 B11R1.24 O=CCOc1cccc(c1)I 34a_100000211634_200009817547 [0,1,1,0,0,0|2,0,0]=4 946 B11R1.24 O=CCOc1cccc(c1)I 7a_100000211634_200015260668 [0,1,1,0,0,0|2,0,0]=4 947 B11R1.24 O=CCSc1cccc(c1)Br 62a_100000691529_200015260668 [0,1,1,0,0,0|2,0,0]=4 948 B11R1.24 O=CCSc1cccc(c1)Br 62a_200015260668_100000691529 [0,1,1,0,0,0|2,0,0]=4 949 B11R1.24 O=CCSc1cccc(c1)Cl 62a_100000699651_200015260668 [0,1,1,0,0,0|2,0,0]=4 950 B11R1.24 O=CCSc1cccc(c1)Cl 62a_200015260668_100000699651 [0,1,1,0,0,0|2,0,0]=4 951 B11R1.24 O=CCSc1cccc(c1)F 62a_100000685547_200015260668 [0,1,1,0,0,0|2,0,0]=4 952 B11R1.24 O=CCSc1cccc(c1)F 62a_200015260668_100000685547 [0,1,1,0,0,0|2,0,0]=4 953 B11R1.24 O=CCSc1cccc(c1)O 62a_200015260668_100000211634 [0,1,1,0,0,0|2,0,0]=4 954 B11R1.24 O=CCSc1cccc(c1)[S] 62a_114929384022_200015260668 [0,1,1,0,0,0|2,0,0]=4 955 B11R1.24 O=CCSc1cccc(c1)[S] 62a_200015260668_114929384022 [0,1,1,0,0,0|2,0,0]=4 956 B11R1.28 BrCCOCc1ccccc1 34a_100000211926_100015291786 [0,1,1,0,0,0|1,0,1]=4 957 B11R1.28 C#CCOCc1ccccc1 34a_100000210247_100015291786 [0,1,1,0,0,0|1,0,1]=4 958 B11R1.28 C#CCOCc1ccccc1 34a_100000210790_100000184674 [0,1,1,0,0,0|1,0,1]=4 959 B11R1.28 C#CCOCc1ccccc1 7a_100000210790_100000038162 [0,1,1,0,0,0|1,0,1]=4 960 B11R1.28 C/C=C/CNc1ccccc1 34a_100000106764_100102629194 [0,1,1,0,0,0|2,0,0]=4 961 B11R1.28 C/C=C/COc1ccccc1 34a_100000210340_100102629194 [0,1,1,0,0,0|2,0,0]=4 962 B11R1.28 C/C=C/COc1ccccc1 7a_100000210340_100102629194 [0,1,1,0,0,0|2,0,0]=4 963 B11R1.28 C/C=C/CSc1ccccc1 62a_100000719477_100102629194 [0,1,1,0,0,0|2,0,0]=4 964 B11R1.28 C/C=C/CSc1ccccc1 62a_100102629194_100000041952 [0,1,1,0,0,0|2,0,0]=4 965 B11R1.28 C=CCCNc1ccccc1 34a_100000106764_100000754431 [0,1,1,0,0,0|2,0,0]=4 966 B11R1.28 C=CCCOc1ccccc1 34a_100000210340_100000754431 [0,1,1,0,0,0|2,0,0]=4 967 B11R1.28 C=CCCOc1ccccc1 7a_100000210340_100000754431 [0,1,1,0,0,0|2,0,0]=4 968 B11R1.28 C=CCCSc1ccccc1 62a_100000719477_100000754431 [0,1,1,0,0,0|2,0,0]=4 969 B11R1.28 C=CCCSc1ccccc1 62a_100000754431_100000041952 [0,1,1,0,0,0|2,0,0]=4 970 B11R1.28 C=CCNCc1ccccc1 2230a_100015324214_100000210623 [0,1,1,0,0,0|2,0,0]=4 971 B11R1.28 C=CCNCc1ccccc1 2230a_100020586998_100015291786 [0,1,1,0,0,0|2,0,0]=4 972 B11R1.28 C=CCNCc1ccccc1 270004a_100020586998_100015611070 [0,1,1,0,0,0|2,0,0]=4 973 B11R1.28 C=CCNCc1ccccc1 34a_100015324214_100015514636 [0,1,1,0,0,0|2,0,0]=4 974 B11R1.28 C=CCOCc1ccccc1 34a_100000210790_100015514636 [0,1,1,0,0,0|1,0,0]=3 975 B11R1.28 C=CCOCc1ccccc1 34a_200000210373_100015291786 [0,1,1,0,0,0|1,0,0]=3 976 B11R1.28 C=CCOCc1ccccc1 7a_100000210790_100015514636 [0,1,1,0,0,0|1,0,0]=3 977 B11R1.28 C=CCOCc1ccccn1 34a_200000210373_100000721315 [0,1,1,0,0,0|2,0,0]=4 978 B11R1.28 C=CCOCc1cccnc1 34a_200000210373_100000733263 [0,1,1,0,0,0|2,0,0]=4 979 B11R1.28 C=CCSCc1ccccc1 62a_100000210623_100015291786 [0,1,1,0,0,0|1,1,0]=4 980 B11R1.28 C=CCSCc1ccccc1 62a_100000211182_100000210623 [0,1,1,0,0,0|1,1,0]=4 981 B11R1.28 CC=CCNc1ccccc1 34a_100000106764_100000070051 [0,1,1,0,0,0|2,0,0]=4 982 B11R1.28 CC=CCOc1ccccc1 34a_100000210340_100000070051 [0,1,1,0,0,0|2,0,0]=4 983 B11R1.28 CC=CCOc1ccccc1 7a_100000210340_100000070051 [0,1,1,0,0,0|2,0,0]=4 984 B11R1.28 CC=CCSc1ccccc1 62a_100000070051_100000041952 [0,1,1,0,0,0|2,0,0]=4 985 B11R1.28 CC=CCSc1ccccc1 62a_100000719477_100000070051 [0,1,1,0,0,0|2,0,0]=4 986 B11R1.28 CC=NNCc1ccccc1 4a_100000007032_200000210099 [0,1,1,0,0,0|2,0,0]=4 987 B11R1.28 CCCOCc1ccccc1 34a_100000210258_100015291786 [0,1,1,0,0,0|1,0,1]=4 988 B11R1.28 CCCOCc1ccccc1 34a_100000210790_100000210303 [0,1,1,0,0,0|1,0,1]=4 989 B11R1.28 CCCOCc1ccccc1 7a_100000210790_100000210303 [0,1,1,0,0,0|1,0,1]=4 990 B11R1.28 CCOCCc1ccccc1 34a_100000210268_100000210202 [0,1,1,0,0,0|1,0,1]=4 991 B11R1.28 CCOCCc1ccccc1 34a_100121572206_100000765856 [0,1,1,0,0,0|1,0,1]=4 992 B11R1.28 CCOCCc1ccccc1 7a_100000210268_100000210202 [0,1,1,0,0,0|1,0,1]=4 993 B11R1.28 CCOCSc1ccccc1 62a_100000719477_100000739092 [0,1,1,0,0,0|1,0,1]=4 994 B11R1.28 CCOCSc1ccccc1 62a_100000739092_100000041952 [0,1,1,0,0,0|1,0,1]=4 995 B11R1.28 CNCOCc1ccccc1 2230a_106832991635_100000763385 [0,1,1,0,0,0|1,0,1]=4 996 B11R1.28 CNCOCc1ccccc1 34a_100102657272_100000763385 [0,1,1,0,0,0|1,0,1]=4 997 B11R1.28 COCOCc1ccccc1 34a_100138415774_100000763385 [0,1,1,0,0,0|0,0,2]=4 998 B11R1.28 CSCOCc1ccccc1 34a_100000210790_100011218213 [0,1,1,0,0,0|0,1,1]=4 999 B11R1.28 CSCOCc1ccccc1 62a_100000763385_200000210301 [0,1,1,0,0,0|0,1,1]=4 1000 B11R1.28 CSCOCc1ccccc1 62a_200000210301_100000763385 [0,1,1,0,0,0|0,1,1]=4 1001 B11R1.28 FCCOCc1ccccc1 34a_100000210790_100011217306 [0,1,1,0,0,0|1,0,1]=4 1002 B11R1.28 FCCOCc1ccccc1 7a_100000210790_100011217306 [0,1,1,0,0,0|1,0,1]=4 1003 B11R1.28 FCOCCc1ccccc1 34a_100000210268_100015361967 [0,1,1,0,0,0|1,0,1]=4 1004 B11R1.28 FCOCCc1ccccc1 7a_100000210268_100015361967 [0,1,1,0,0,0|1,0,1]=4 1005 B11R1.28 N#CCOCc1ccccc1 7a_100000210790_100011215382 [0,1,1,0,0,0|1,0,1]=4 1006 B11R1.28 NCCOCc1ccccc1 34a_100000210304_100015291786 [0,1,1,0,0,0|1,0,1]=4 1007 B11R1.28 O=CCNCc1ccccc1 2230a_100015324214_200015260668 [0,1,1,0,0,0|1,0,0]=3 1008 B11R1.28 O=CCNCc1ccccc1 34a_100015324214_200009817547 [0,1,1,0,0,0|1,0,0]=3 1009 B11R1.28 O=CCOCc1ccccc1 34a_100000210790_200009817547 [0,1,1,0,0,0|0,0,0]=2 1010 B11R1.28 O=CCOCc1ccccc1 7a_100000210790_200015260668 [0,1,1,0,0,0|0,0,0]=2 1011 B11R1.28 O=CCSCc1ccccc1 62a_100000211182_200015260668 [0,1,1,0,0,0|0,1,0]=3 1012 B11R1.28 O=CCSCc1ccccc1 62a_200015260668_100015291786 [0,1,1,0,0,0|0,1,0]=3 1013 B11R1.28 O=CCSCc1ccccn1 62a_100000721315_200015260668 [0,1,1,0,0,0|1,1,0]=4 1014 B11R1.28 O=CCSCc1ccccn1 62a_200015260668_100000721315 [0,1,1,0,0,0|1,1,0]=4 1015 B11R1.28 O=CCSCc1cccnc1 62a_100000741622_200015260668 [0,1,1,0,0,0|1,1,0]=4 1016 B11R1.28 O=CCSCc1cccnc1 62a_200015260668_100000741622 [0,1,1,0,0,0|1,1,0]=4 1017 B11R1.28 O=CCSCc1ccncc1 62a_100015193705_200015260668 [0,1,1,0,0,0|1,1,0]=4 1018 B11R1.28 O=CCSCc1ccncc1 62a_200015260668_100015193705 [0,1,1,0,0,0|1,1,0]=4 1019 B11R1.28 OCCOCc1ccccc1 34a_100000210790_100000211926 [0,1,1,0,0,0|0,0,2]=4 1020 B11R1.28 OCCOCc1ccccc1 7a_100000210790_100000211926 [0,1,1,0,0,0|0,0,2]=4 1021 B11R1.28 [13CH3]SCOCc1ccccc1 62a_100000763385_200025704644 [0,1,1,0,0,0|0,1,1]=4 1022 B11R1.28 [13CH3]SCOCc1ccccc1 62a_200025704644_100000763385 [0,1,1,0,0,0|0,1,1]=4 1023 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,1,1,0,0,0|2,0,0]=4 1024 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [0,1,1,0,0,0|1,0,1]=4 1025 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,1,1,0,0,0|1,0,1]=4 1026 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [0,1,1,0,0,0|1,0,0]=3 1027 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [0,1,1,0,0,0|1,0,0]=3 1028 B11R1.91 CC(=O)CCc1ccccn1 1458a_100000070787_100015183660 [0,1,1,0,0,0|2,0,0]=4 1029 B11R1.91 CC(=O)CCc1ccccn1 1458a_100015195070_200000210301 [0,1,1,0,0,0|2,0,0]=4 1030 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000070787_200011713674 [0,1,1,0,0,0|2,0,0]=4 1031 B11R1.91 CC(=O)CCc1cccnc1 1458a_100000198484_200000210301 [0,1,1,0,0,0|2,0,0]=4 1032 B11R1.91 CC(=O)CCc1ccncc1 1458a_100000070787_100000723409 [0,1,1,0,0,0|2,0,0]=4 1033 B11R1.91 CC(=O)CCc1ccncc1 1458a_100011225043_200000210301 [0,1,1,0,0,0|2,0,0]=4 1034 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,1,1,0,0,0|2,0,0]=4 1035 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,1,1,0,0,0|2,0,0]=4 1036 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,1,1,0,0,0|1,0,0]=3 1037 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,1,1,0,0,0|1,0,0]=3 1038 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,1,1,0,0,0|1,0,0]=3 1039 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,1,1,0,0,0|1,0,0]=3 1040 B11R1.91 CC(=O)NCc1ccccn1 11a_100000210449_100015343762 [0,1,1,0,0,0|2,0,0]=4 1041 B11R1.91 CC(=O)NCc1ccccn1 1626a_100000210449_100015343762 [0,1,1,0,0,0|2,0,0]=4 1042 B11R1.91 CC(=O)NCc1ccccn1 240690a_100000210449_100015343762 [0,1,1,0,0,0|2,0,0]=4 1043 B11R1.91 CC(=O)NCc1ccccn1 527a_100000210449_100103153847 [0,1,1,0,0,0|2,0,0]=4 1044 B11R1.91 CC(=O)NCc1cccnc1 11a_100000210453_100015343762 [0,1,1,0,0,0|2,0,0]=4 1045 B11R1.91 CC(=O)NCc1cccnc1 240690a_100000210453_100015343762 [0,1,1,0,0,0|2,0,0]=4 1046 B11R1.91 CC(=O)NCc1cccnc1 527a_100000210453_100103153847 [0,1,1,0,0,0|2,0,0]=4 1047 B11R1.91 CC(=O)NCc1ccncc1 11a_100000210450_100015343762 [0,1,1,0,0,0|2,0,0]=4 1048 B11R1.91 CC(=O)NCc1ccncc1 1626a_100000210450_100015343762 [0,1,1,0,0,0|2,0,0]=4 1049 B11R1.91 CC(=O)NCc1ccncc1 240690a_100000210450_100015343762 [0,1,1,0,0,0|2,0,0]=4 1050 B11R1.91 CC(=O)NCc1ccncc1 527a_100000210450_100103153847 [0,1,1,0,0,0|2,0,0]=4 1051 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [0,1,1,0,0,0|2,0,0]=4 1052 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [0,1,1,0,0,0|1,0,1]=4 1053 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [0,1,1,0,0,0|1,0,1]=4 1054 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [0,1,1,0,0,0|1,0,1]=4 1055 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [0,1,1,0,0,0|2,0,0]=4 1056 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,1,1,0,0,0|2,0,0]=4 1057 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,1,1,0,0,0|2,0,0]=4 1058 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [0,1,1,0,0,0|2,0,0]=4 1059 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [0,1,1,0,0,0|2,0,0]=4 1060 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [0,1,1,0,0,0|2,0,0]=4 1061 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,1,1,0,0,0|2,0,0]=4 1062 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [0,1,1,0,0,0|2,0,0]=4 1063 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [0,1,1,0,0,0|2,0,0]=4 1064 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [0,1,1,0,0,0|1,0,1]=4 1065 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,1,1,0,0,0|1,0,1]=4 1066 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [0,1,1,0,0,0|1,0,0]=3 1067 B11R1.91 [13CH3]C(=O)CCc1ccccn1 1458a_100015195070_200025704644 [0,1,1,0,0,0|2,0,0]=4 1068 B11R1.91 [13CH3]C(=O)CCc1cccnc1 1458a_100000198484_200025704644 [0,1,1,0,0,0|2,0,0]=4 1069 B11R1.91 [13CH3]C(=O)CCc1ccncc1 1458a_100011225043_200025704644 [0,1,1,0,0,0|2,0,0]=4 1070 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,1,1,0,0,0|2,0,0]=4 1071 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,1,1,0,0,0|2,0,0]=4 1072 B11R1.37 C=Cc1cc(ccc1C=O)Br 271570a_100011290941_100010146562 [0,1,1,0,0,0|1,0,1]=4 1073 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [0,1,1,0,0,0|1,0,1]=4 1074 B11R1.37 C=Cc1cc(ccc1C=O)F 271570a_100011290941_100000752949 [0,1,1,0,0,0|1,0,1]=4 1075 B11R1.37 C=Cc1cc(ccc1C=O)O 271570a_100011290941_100011236494 [0,1,1,0,0,0|1,0,1]=4 1076 B11R1.37 C=Cc1cc(ccc1CN)F 271570a_100011290941_100000708791 [0,1,1,0,0,0|2,0,0]=4 1077 B11R1.37 C=Cc1cc(ccc1CO)Br 271570a_100011290941_100010146605 [0,1,1,0,0,0|1,0,0]=3 1078 B11R1.37 C=Cc1cc(ccc1CO)Cl 271570a_100011290941_100000722340 [0,1,1,0,0,0|1,0,0]=3 1079 B11R1.37 C=Cc1cc(ccc1CO)F 271570a_100011290941_100000744086 [0,1,1,0,0,0|1,0,0]=3 1080 B11R1.37 C=Cc1cc(ccc1CO)O 271570a_100011290941_100010146404 [0,1,1,0,0,0|1,0,0]=3 1081 B11R1.37 C=Cc1ccc(cc1C=O)Br 271570a_100011290941_100010185651 [0,1,1,0,0,0|1,0,1]=4 1082 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [0,1,1,0,0,0|1,0,1]=4 1083 B11R1.37 C=Cc1ccc(cc1C=O)Cl 271570a_100011290941_100010254386 [0,1,1,0,0,0|1,0,1]=4 1084 B11R1.37 C=Cc1ccc(cc1C=O)F 271570a_100011290941_100011218309 [0,1,1,0,0,0|1,0,1]=4 1085 B11R1.37 C=Cc1ccc(cc1C=O)O 271570a_100011290941_100000690577 [0,1,1,0,0,0|1,0,1]=4 1086 B11R1.37 C=Cc1ccc(cc1CC)Br 271570a_100011290941_100011216195 [0,1,1,0,0,0|2,0,0]=4 1087 B11R1.37 C=Cc1ccc(cc1CC)N 271570a_100011290941_100010109747 [0,1,1,0,0,0|2,0,0]=4 1088 B11R1.37 C=Cc1ccc(cc1CN)F 271570a_100011290941_100000742738 [0,1,1,0,0,0|2,0,0]=4 1089 B11R1.37 C=Cc1ccc(cc1CO)Br 271570a_100011290941_100011356890 [0,1,1,0,0,0|1,0,0]=3 1090 B11R1.37 C=Cc1ccc(cc1CO)C 271570a_100011290941_100012361352 [0,1,1,0,0,0|1,0,0]=3 1091 B11R1.37 C=Cc1ccc(cc1CO)F 271570a_100011290941_100011217561 [0,1,1,0,0,0|1,0,0]=3 1092 B11R1.37 C=Cc1ccc(cc1CO)N 271570a_100011290941_100012347228 [0,1,1,0,0,0|1,0,0]=3 1093 B11R1.37 C=Cc1ccc(cc1CO)O 271570a_100011290941_100012351483 [0,1,1,0,0,0|1,0,0]=3 1094 B11R1.37 C=Cc1ccc(nc1CO)C 271570a_100011290941_100010074375 [0,1,1,0,0,0|2,0,0]=4 1095 B11R1.37 C=Cc1ccc(nc1CO)F 271570a_100011290941_100000701195 [0,1,1,0,0,0|2,0,0]=4 1096 B11R1.37 C=Cc1cnc(cc1CO)C 271570a_100011290941_100015579599 [0,1,1,0,0,0|2,0,0]=4 1097 B11R1.37 C=Cc1nc(ccc1CO)C 271570a_100011290941_102495338573 [0,1,1,0,0,0|2,0,0]=4 1098 B11R1.37 C=Cc1ncc(cc1CO)C 271570a_100011290941_100000118064 [0,1,1,0,0,0|2,0,0]=4 1099 B11R1.37 C=Cc1ncc(cc1CO)F 271570a_100011290941_100000079972 [0,1,1,0,0,0|2,0,0]=4 1100 B11R1.37 CCc1cc(ccc1C=O)O 271570a_203496583355_100010209654 [0,1,1,0,0,0|1,0,0]=3 1101 B11R1.37 CCc1ccc(cc1CO)O 271570a_203496583355_100010766240 [0,1,1,0,0,0|1,0,1]=4 1102 B11R1.37 CNc1cc(ccc1CO)Br 34a_100000718831_200000210301 [0,1,1,0,0,0|2,0,0]=4 1103 B11R1.37 CNc1cc(ccc1CO)C 34a_100000087799_200000210301 [0,1,1,0,0,0|2,0,0]=4 1104 B11R1.37 CNc1cc(ccc1CO)Cl 34a_100000238622_200000210301 [0,1,1,0,0,0|2,0,0]=4 1105 B11R1.37 CNc1cc(ccc1CO)F 34a_100011996588_200000210301 [0,1,1,0,0,0|2,0,0]=4 1106 B11R1.37 CNc1ccc(cc1CO)Br 34a_100012353972_200000210301 [0,1,1,0,0,0|2,0,0]=4 1107 B11R1.37 CNc1ccc(cc1CO)C 34a_100011215565_200000210301 [0,1,1,0,0,0|2,0,0]=4 1108 B11R1.37 CNc1ccc(cc1CO)Cl 34a_100011214999_200000210301 [0,1,1,0,0,0|2,0,0]=4 1109 B11R1.37 CNc1ccc(cc1CO)F 34a_100011296978_200000210301 [0,1,1,0,0,0|2,0,0]=4 1110 B11R1.37 COc1cc(ccc1C=O)O 271570a_203496583355_100000697075 [0,1,1,0,0,0|2,0,0]=4 1111 B11R1.37 COc1cc(ccc1CO)Br 34a_100000071718_200000210301 [0,1,1,0,0,0|2,0,0]=4 1112 B11R1.37 COc1cc(ccc1CO)Br 7a_100000071718_200000210301 [0,1,1,0,0,0|2,0,0]=4 1113 B11R1.37 COc1cc(ccc1CO)O 271570a_203496583355_100011277633 [0,1,1,0,0,0|2,0,0]=4 1114 B11R1.37 COc1ccc(cc1C=O)O 271570a_203496583355_100000170026 [0,1,1,0,0,0|2,0,0]=4 1115 B11R1.37 COc1ccc(cc1CO)Br 34a_100000184703_200000210301 [0,1,1,0,0,0|2,0,0]=4 1116 B11R1.37 COc1ccc(cc1CO)Br 7a_100000184703_200000210301 [0,1,1,0,0,0|2,0,0]=4 1117 B11R1.37 COc1ccc(cc1CO)C 34a_200011846009_200000210301 [0,1,1,0,0,0|2,0,0]=4 1118 B11R1.37 COc1ccc(cc1CO)C 7a_200011846009_200000210301 [0,1,1,0,0,0|2,0,0]=4 1119 B11R1.37 COc1ccc(cc1CO)Cl 34a_100011218961_200000210301 [0,1,1,0,0,0|2,0,0]=4 1120 B11R1.37 COc1ccc(cc1CO)Cl 7a_100011218961_200000210301 [0,1,1,0,0,0|2,0,0]=4 1121 B11R1.37 COc1ccc(cc1CO)F 34a_100011291448_200000210301 [0,1,1,0,0,0|2,0,0]=4 1122 B11R1.37 COc1ccc(cc1CO)F 7a_100011291448_200000210301 [0,1,1,0,0,0|2,0,0]=4 1123 B11R1.37 COc1ccc(cc1CO)I 34a_100000049520_200000210301 [0,1,1,0,0,0|2,0,0]=4 1124 B11R1.37 COc1ccc(cc1CO)I 7a_100000049520_200000210301 [0,1,1,0,0,0|2,0,0]=4 1125 B11R1.37 COc1ccc(cc1CO)O 271570a_203496583355_100000204679 [0,1,1,0,0,0|2,0,0]=4 1126 B11R1.37 CSc1cc(ccc1C=O)Br 62a_100010146562_200000210301 [0,1,1,0,0,0|2,0,0]=4 1127 B11R1.37 CSc1cc(ccc1C=O)Br 62a_200000210301_100010146562 [0,1,1,0,0,0|2,0,0]=4 1128 B11R1.37 CSc1cc(ccc1C=O)C 62a_100011935181_200000210301 [0,1,1,0,0,0|2,0,0]=4 1129 B11R1.37 CSc1cc(ccc1C=O)C 62a_200000210301_100011935181 [0,1,1,0,0,0|2,0,0]=4 1130 B11R1.37 CSc1cc(ccc1C=O)F 62a_100000752949_200000210301 [0,1,1,0,0,0|2,0,0]=4 1131 B11R1.37 CSc1cc(ccc1C=O)F 62a_200000210301_100000752949 [0,1,1,0,0,0|2,0,0]=4 1132 B11R1.37 CSc1cc(ccc1C=O)O 62a_100011236494_200000210301 [0,1,1,0,0,0|2,0,0]=4 1133 B11R1.37 CSc1cc(ccc1C=O)O 62a_200000210301_100011236494 [0,1,1,0,0,0|2,0,0]=4 1134 B11R1.37 CSc1cc(ccc1CO)Br 62a_100010146605_200000210301 [0,1,1,0,0,0|2,0,0]=4 1135 B11R1.37 CSc1cc(ccc1CO)Br 62a_200000210301_100010146605 [0,1,1,0,0,0|2,0,0]=4 1136 B11R1.37 CSc1cc(ccc1CO)Cl 62a_100000722340_200000210301 [0,1,1,0,0,0|2,0,0]=4 1137 B11R1.37 CSc1cc(ccc1CO)Cl 62a_200000210301_100000722340 [0,1,1,0,0,0|2,0,0]=4 1138 B11R1.37 CSc1cc(ccc1CO)F 62a_100000744086_200000210301 [0,1,1,0,0,0|2,0,0]=4 1139 B11R1.37 CSc1cc(ccc1CO)F 62a_200000210301_100000744086 [0,1,1,0,0,0|2,0,0]=4 1140 B11R1.37 CSc1cc(ccc1CO)O 62a_100010146404_200000210301 [0,1,1,0,0,0|2,0,0]=4 1141 B11R1.37 CSc1cc(ccc1CO)O 62a_200000210301_100010146404 [0,1,1,0,0,0|2,0,0]=4 1142 B11R1.37 CSc1ccc(cc1C=O)Br 62a_100010185651_200000210301 [0,1,1,0,0,0|2,0,0]=4 1143 B11R1.37 CSc1ccc(cc1C=O)Br 62a_200000210301_100010185651 [0,1,1,0,0,0|2,0,0]=4 1144 B11R1.37 CSc1ccc(cc1C=O)C 62a_100011551863_200000210301 [0,1,1,0,0,0|2,0,0]=4 1145 B11R1.37 CSc1ccc(cc1C=O)C 62a_200000210301_100011551863 [0,1,1,0,0,0|2,0,0]=4 1146 B11R1.37 CSc1ccc(cc1C=O)Cl 62a_100010254386_200000210301 [0,1,1,0,0,0|2,0,0]=4 1147 B11R1.37 CSc1ccc(cc1C=O)Cl 62a_200000210301_100010254386 [0,1,1,0,0,0|2,0,0]=4 1148 B11R1.37 CSc1ccc(cc1C=O)F 62a_100011218309_200000210301 [0,1,1,0,0,0|2,0,0]=4 1149 B11R1.37 CSc1ccc(cc1C=O)F 62a_200000210301_100011218309 [0,1,1,0,0,0|2,0,0]=4 1150 B11R1.37 CSc1ccc(cc1C=O)O 62a_100000690577_200000210301 [0,1,1,0,0,0|2,0,0]=4 1151 B11R1.37 CSc1ccc(cc1C=O)O 62a_200000210301_100000690577 [0,1,1,0,0,0|2,0,0]=4 1152 B11R1.37 CSc1ccc(cc1CO)Br 62a_100011356890_200000210301 [0,1,1,0,0,0|2,0,0]=4 1153 B11R1.37 CSc1ccc(cc1CO)Br 62a_200000210301_100011356890 [0,1,1,0,0,0|2,0,0]=4 1154 B11R1.37 CSc1ccc(cc1CO)C 62a_100012361352_200000210301 [0,1,1,0,0,0|2,0,0]=4 1155 B11R1.37 CSc1ccc(cc1CO)C 62a_200000210301_100012361352 [0,1,1,0,0,0|2,0,0]=4 1156 B11R1.37 CSc1ccc(cc1CO)F 62a_100011217561_200000210301 [0,1,1,0,0,0|2,0,0]=4 1157 B11R1.37 CSc1ccc(cc1CO)F 62a_200000210301_100011217561 [0,1,1,0,0,0|2,0,0]=4 1158 B11R1.37 CSc1ccc(cc1CO)N 62a_100012347228_200000210301 [0,1,1,0,0,0|2,0,0]=4 1159 B11R1.37 CSc1ccc(cc1CO)N 62a_200000210301_100012347228 [0,1,1,0,0,0|2,0,0]=4 1160 B11R1.37 CSc1ccc(cc1CO)O 62a_100012351483_200000210301 [0,1,1,0,0,0|2,0,0]=4 1161 B11R1.37 CSc1ccc(cc1CO)O 62a_200000210301_100012351483 [0,1,1,0,0,0|2,0,0]=4 1162 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_100011551863_200025704644 [0,1,1,0,0,0|2,0,0]=4 1163 B11R1.37 Cc1ccc(c(c1)C=O)S[13CH3] 62a_200025704644_100011551863 [0,1,1,0,0,0|2,0,0]=4 1164 B11R1.37 Cc1ccc(c(c1)CO)N[13CH3] 34a_100011215565_200025704644 [0,1,1,0,0,0|2,0,0]=4 1165 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 34a_200011846009_200025704644 [0,1,1,0,0,0|2,0,0]=4 1166 B11R1.37 Cc1ccc(c(c1)CO)O[13CH3] 7a_200011846009_200025704644 [0,1,1,0,0,0|2,0,0]=4 1167 B11R1.37 Cc1ccc(c(c1)CO)S[13CH3] 62a_100012361352_200025704644 [0,1,1,0,0,0|2,0,0]=4 1168 B11R1.37 Cc1ccc(c(c1)CO)S[13CH3] 62a_200025704644_100012361352 [0,1,1,0,0,0|2,0,0]=4 1169 B11R1.37 Cc1ccc(c(c1)N[13CH3])CO 34a_100000087799_200025704644 [0,1,1,0,0,0|2,0,0]=4 1170 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_100011935181_200025704644 [0,1,1,0,0,0|2,0,0]=4 1171 B11R1.37 Cc1ccc(c(c1)S[13CH3])C=O 62a_200025704644_100011935181 [0,1,1,0,0,0|2,0,0]=4 1172 B11R1.37 N#Cc1cc(ccc1C=O)O 271570a_203496583355_100012001787 [0,1,1,0,0,0|1,0,1]=4 1173 B11R1.37 N#Cc1ccc(cc1C=O)O 271570a_203496583355_100010194279 [0,1,1,0,0,0|1,0,1]=4 1174 B11R1.37 O=Cc1ccc(cc1C=O)O 271570a_203496583355_200010077131 [0,1,1,0,0,0|0,0,2]=4 1175 B11R1.37 OCc1ccc(cc1CO)O 271570a_203496583355_100000719600 [0,1,1,0,0,0|0,0,2]=4 1176 B11R1.37 [13CH3]Nc1cc(ccc1CO)Br 34a_100000718831_200025704644 [0,1,1,0,0,0|2,0,0]=4 1177 B11R1.37 [13CH3]Nc1cc(ccc1CO)Cl 34a_100000238622_200025704644 [0,1,1,0,0,0|2,0,0]=4 1178 B11R1.37 [13CH3]Nc1cc(ccc1CO)F 34a_100011996588_200025704644 [0,1,1,0,0,0|2,0,0]=4 1179 B11R1.37 [13CH3]Nc1ccc(cc1CO)Br 34a_100012353972_200025704644 [0,1,1,0,0,0|2,0,0]=4 1180 B11R1.37 [13CH3]Nc1ccc(cc1CO)Cl 34a_100011214999_200025704644 [0,1,1,0,0,0|2,0,0]=4 1181 B11R1.37 [13CH3]Nc1ccc(cc1CO)F 34a_100011296978_200025704644 [0,1,1,0,0,0|2,0,0]=4 1182 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 34a_100000071718_200025704644 [0,1,1,0,0,0|2,0,0]=4 1183 B11R1.37 [13CH3]Oc1cc(ccc1CO)Br 7a_100000071718_200025704644 [0,1,1,0,0,0|2,0,0]=4 1184 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 34a_100000184703_200025704644 [0,1,1,0,0,0|2,0,0]=4 1185 B11R1.37 [13CH3]Oc1ccc(cc1CO)Br 7a_100000184703_200025704644 [0,1,1,0,0,0|2,0,0]=4 1186 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 34a_100011218961_200025704644 [0,1,1,0,0,0|2,0,0]=4 1187 B11R1.37 [13CH3]Oc1ccc(cc1CO)Cl 7a_100011218961_200025704644 [0,1,1,0,0,0|2,0,0]=4 1188 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 34a_100011291448_200025704644 [0,1,1,0,0,0|2,0,0]=4 1189 B11R1.37 [13CH3]Oc1ccc(cc1CO)F 7a_100011291448_200025704644 [0,1,1,0,0,0|2,0,0]=4 1190 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 34a_100000049520_200025704644 [0,1,1,0,0,0|2,0,0]=4 1191 B11R1.37 [13CH3]Oc1ccc(cc1CO)I 7a_100000049520_200025704644 [0,1,1,0,0,0|2,0,0]=4 1192 B11R1.37 [13CH3]Sc1cc(ccc1C=O)Br 62a_100010146562_200025704644 [0,1,1,0,0,0|2,0,0]=4 1193 B11R1.37 [13CH3]Sc1cc(ccc1C=O)Br 62a_200025704644_100010146562 [0,1,1,0,0,0|2,0,0]=4 1194 B11R1.37 [13CH3]Sc1cc(ccc1C=O)F 62a_100000752949_200025704644 [0,1,1,0,0,0|2,0,0]=4 1195 B11R1.37 [13CH3]Sc1cc(ccc1C=O)F 62a_200025704644_100000752949 [0,1,1,0,0,0|2,0,0]=4 1196 B11R1.37 [13CH3]Sc1cc(ccc1C=O)O 62a_100011236494_200025704644 [0,1,1,0,0,0|2,0,0]=4 1197 B11R1.37 [13CH3]Sc1cc(ccc1C=O)O 62a_200025704644_100011236494 [0,1,1,0,0,0|2,0,0]=4 1198 B11R1.37 [13CH3]Sc1cc(ccc1CO)Br 62a_100010146605_200025704644 [0,1,1,0,0,0|2,0,0]=4 1199 B11R1.37 [13CH3]Sc1cc(ccc1CO)Br 62a_200025704644_100010146605 [0,1,1,0,0,0|2,0,0]=4 1200 B11R1.37 [13CH3]Sc1cc(ccc1CO)Cl 62a_100000722340_200025704644 [0,1,1,0,0,0|2,0,0]=4 1201 B11R1.37 [13CH3]Sc1cc(ccc1CO)Cl 62a_200025704644_100000722340 [0,1,1,0,0,0|2,0,0]=4 1202 B11R1.37 [13CH3]Sc1cc(ccc1CO)F 62a_100000744086_200025704644 [0,1,1,0,0,0|2,0,0]=4 1203 B11R1.37 [13CH3]Sc1cc(ccc1CO)F 62a_200025704644_100000744086 [0,1,1,0,0,0|2,0,0]=4 1204 B11R1.37 [13CH3]Sc1cc(ccc1CO)O 62a_100010146404_200025704644 [0,1,1,0,0,0|2,0,0]=4 1205 B11R1.37 [13CH3]Sc1cc(ccc1CO)O 62a_200025704644_100010146404 [0,1,1,0,0,0|2,0,0]=4 1206 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Br 62a_100010185651_200025704644 [0,1,1,0,0,0|2,0,0]=4 1207 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Br 62a_200025704644_100010185651 [0,1,1,0,0,0|2,0,0]=4 1208 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Cl 62a_100010254386_200025704644 [0,1,1,0,0,0|2,0,0]=4 1209 B11R1.37 [13CH3]Sc1ccc(cc1C=O)Cl 62a_200025704644_100010254386 [0,1,1,0,0,0|2,0,0]=4 1210 B11R1.37 [13CH3]Sc1ccc(cc1C=O)F 62a_100011218309_200025704644 [0,1,1,0,0,0|2,0,0]=4 1211 B11R1.37 [13CH3]Sc1ccc(cc1C=O)F 62a_200025704644_100011218309 [0,1,1,0,0,0|2,0,0]=4 1212 B11R1.37 [13CH3]Sc1ccc(cc1C=O)O 62a_100000690577_200025704644 [0,1,1,0,0,0|2,0,0]=4 1213 B11R1.37 [13CH3]Sc1ccc(cc1C=O)O 62a_200025704644_100000690577 [0,1,1,0,0,0|2,0,0]=4 1214 B11R1.37 [13CH3]Sc1ccc(cc1CO)Br 62a_100011356890_200025704644 [0,1,1,0,0,0|2,0,0]=4 1215 B11R1.37 [13CH3]Sc1ccc(cc1CO)Br 62a_200025704644_100011356890 [0,1,1,0,0,0|2,0,0]=4 1216 B11R1.37 [13CH3]Sc1ccc(cc1CO)F 62a_100011217561_200025704644 [0,1,1,0,0,0|2,0,0]=4 1217 B11R1.37 [13CH3]Sc1ccc(cc1CO)F 62a_200025704644_100011217561 [0,1,1,0,0,0|2,0,0]=4 1218 B11R1.37 [13CH3]Sc1ccc(cc1CO)N 62a_100012347228_200025704644 [0,1,1,0,0,0|2,0,0]=4 1219 B11R1.37 [13CH3]Sc1ccc(cc1CO)N 62a_200025704644_100012347228 [0,1,1,0,0,0|2,0,0]=4 1220 B11R1.37 [13CH3]Sc1ccc(cc1CO)O 62a_100012351483_200025704644 [0,1,1,0,0,0|2,0,0]=4 1221 B11R1.37 [13CH3]Sc1ccc(cc1CO)O 62a_200025704644_100012351483 [0,1,1,0,0,0|2,0,0]=4 1222 B11R1.41 C#Cc1ccccc1COC 34a_100000054652_200000210301 [0,1,1,0,0,0|1,0,1]=4 1223 B11R1.41 C#Cc1ccccc1COC 7a_100000054652_200000210301 [0,1,1,0,0,0|1,0,1]=4 1224 B11R1.41 C#Cc1ccccc1CO[13CH3] 34a_100000054652_200025704644 [0,1,1,0,0,0|1,0,1]=4 1225 B11R1.41 C#Cc1ccccc1CO[13CH3] 7a_100000054652_200025704644 [0,1,1,0,0,0|1,0,1]=4 1226 B11R1.41 C=C=Cc1ccccc1C=O 271570a_100015277604_100000211189 [0,1,1,0,0,0|1,0,1]=4 1227 B11R1.41 C=C=Cc1ccccc1CC 271570a_100015277604_100011215823 [0,1,1,0,0,0|2,0,0]=4 1228 B11R1.41 C=C=Cc1ccccc1CN 271570a_100015277604_100000689332 [0,1,1,0,0,0|2,0,0]=4 1229 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [0,1,1,0,0,0|1,0,0]=3 1230 B11R1.41 C=C=Cc1cccnc1CO 271570a_100015277604_100011996772 [0,1,1,0,0,0|2,0,0]=4 1231 B11R1.41 C=C=Cc1ccncc1CO 271570a_100015277604_100000117392 [0,1,1,0,0,0|2,0,0]=4 1232 B11R1.41 C=C=Cc1cnccc1CO 271570a_100015277604_100009873359 [0,1,1,0,0,0|2,0,0]=4 1233 B11R1.41 C=C=Cc1ncccc1CO 271570a_100015277604_100000748726 [0,1,1,0,0,0|2,0,0]=4 1234 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,1,1,0,0,0|2,0,0]=4 1235 B11R1.41 C=Cc1ccccc1CC#N 271570a_100011290941_100000033512 [0,1,1,0,0,0|2,0,0]=4 1236 B11R1.41 C=Cc1ccccc1CCN 271570a_100011290941_100000747383 [0,1,1,0,0,0|2,0,0]=4 1237 B11R1.41 C=Cc1ccccc1CCO 271570a_100011290941_100000731337 [0,1,1,0,0,0|1,0,0]=3 1238 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,1,1,0,0,0|2,0,0]=4 1239 B11R1.41 C=Cc1ccccc1CNN 271570a_100011290941_200016993956 [0,1,1,0,0,0|2,0,0]=4 1240 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,1,1,0,0,0|1,0,0]=3 1241 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,1,1,0,0,0|1,0,0]=3 1242 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,1,1,0,0,0|1,0,0]=3 1243 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,1,1,0,0,0|1,0,0]=3 1244 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,1,1,0,0,0|1,0,0]=3 1245 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,1,1,0,0,0|1,1,0]=4 1246 B11R1.41 C=Cc1ccccc1NCC 271570a_100011290941_114873767003 [0,1,1,0,0,0|2,0,0]=4 1247 B11R1.41 C=Cc1ccccc1NCC 34a_100012022501_100000210202 [0,1,1,0,0,0|2,0,0]=4 1248 B11R1.41 C=Cc1ccccc1NCF 34a_100012022501_100015361967 [0,1,1,0,0,0|2,0,0]=4 1249 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,1,1,0,0,0|2,0,0]=4 1250 B11R1.41 C=Cc1ccccc1SCC 271570a_100011290941_100000230856 [0,1,1,0,0,0|2,0,0]=4 1251 B11R1.41 C=Cc1ccccc1SCC 62a_100000210202_100011218376 [0,1,1,0,0,0|2,0,0]=4 1252 B11R1.41 C=Cc1ccccc1SCC 62a_100011218376_100000210202 [0,1,1,0,0,0|2,0,0]=4 1253 B11R1.41 C=Cc1ccccc1SCF 62a_100011218376_100015361967 [0,1,1,0,0,0|2,0,0]=4 1254 B11R1.41 C=Cc1ccccc1SCF 62a_100015361967_100011218376 [0,1,1,0,0,0|2,0,0]=4 1255 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,1,1,0,0,0|1,0,1]=4 1256 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [0,1,1,0,0,0|2,0,0]=4 1257 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,1,1,0,0,0|2,0,0]=4 1258 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,1,1,0,0,0|1,0,0]=3 1259 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,1,1,0,0,0|2,0,0]=4 1260 B11R1.41 CC=Cc1ccncc1CO 271570a_100016259895_100000117392 [0,1,1,0,0,0|2,0,0]=4 1261 B11R1.41 CC=Cc1cnccc1CO 271570a_100016259895_100009873359 [0,1,1,0,0,0|2,0,0]=4 1262 B11R1.41 CC=Cc1ncccc1CO 271570a_100016259895_100000748726 [0,1,1,0,0,0|2,0,0]=4 1263 B11R1.41 CCNc1ccccc1CO 34a_100000212039_100000210202 [0,1,1,0,0,0|1,0,1]=4 1264 B11R1.41 CCOc1ccccc1CO 34a_100011216872_100000210202 [0,1,1,0,0,0|1,0,1]=4 1265 B11R1.41 CCSc1ccccc1C=O 62a_100000210073_100000210202 [0,1,1,0,0,0|1,0,0]=3 1266 B11R1.41 CCSc1ccccc1C=O 62a_100000210202_100000210073 [0,1,1,0,0,0|1,0,0]=3 1267 B11R1.41 CCSc1ccccc1CO 62a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 1268 B11R1.41 CCSc1ccccc1CO 62a_100000210202_100000187465 [0,1,1,0,0,0|1,0,1]=4 1269 B11R1.41 CCSc1cccnc1C=O 62a_100000210202_100011934733 [0,1,1,0,0,0|2,0,0]=4 1270 B11R1.41 CCSc1cccnc1C=O 62a_100011934733_100000210202 [0,1,1,0,0,0|2,0,0]=4 1271 B11R1.41 CCSc1ccncc1C=O 62a_100000050567_100000210202 [0,1,1,0,0,0|2,0,0]=4 1272 B11R1.41 CCSc1ccncc1C=O 62a_100000210202_100000050567 [0,1,1,0,0,0|2,0,0]=4 1273 B11R1.41 CCSc1cnccc1C=O 62a_100000210202_100011934409 [0,1,1,0,0,0|2,0,0]=4 1274 B11R1.41 CCSc1cnccc1C=O 62a_100011934409_100000210202 [0,1,1,0,0,0|2,0,0]=4 1275 B11R1.41 CCSc1ncccc1C=O 62a_100000210202_100009816751 [0,1,1,0,0,0|2,0,0]=4 1276 B11R1.41 CCSc1ncccc1C=O 62a_100009816751_100000210202 [0,1,1,0,0,0|2,0,0]=4 1277 B11R1.41 CCc1ccccc1COC 34a_100011663872_200000210301 [0,1,1,0,0,0|1,0,1]=4 1278 B11R1.41 CCc1ccccc1COC 7a_100011663872_200000210301 [0,1,1,0,0,0|1,0,1]=4 1279 B11R1.41 CCc1ccccc1CO[13CH3] 34a_100011663872_200025704644 [0,1,1,0,0,0|1,0,1]=4 1280 B11R1.41 CCc1ccccc1CO[13CH3] 7a_100011663872_200025704644 [0,1,1,0,0,0|1,0,1]=4 1281 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [0,1,1,0,0,0|1,0,0]=3 1282 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [0,1,1,0,0,0|1,0,0]=3 1283 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [0,1,1,0,0,0|1,0,0]=3 1284 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [0,1,1,0,0,0|1,0,1]=4 1285 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [0,1,1,0,0,0|1,0,1]=4 1286 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [0,1,1,0,0,0|1,0,1]=4 1287 B11R1.41 CNc1ccccc1CCO 2230a_100011215289_200000210301 [0,1,1,0,0,0|2,0,0]=4 1288 B11R1.41 CNc1ccccc1CCO 34a_100011215289_200000210301 [0,1,1,0,0,0|2,0,0]=4 1289 B11R1.41 COCc1ccccc1C#N 34a_100138415774_100000181865 [0,1,1,0,0,0|1,0,1]=4 1290 B11R1.41 COCc1ccccc1C#N 34a_200011269968_200000210301 [0,1,1,0,0,0|1,0,1]=4 1291 B11R1.41 COCc1ccccc1C#N 7a_200011269968_200000210301 [0,1,1,0,0,0|1,0,1]=4 1292 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [0,1,1,0,0,0|0,0,0]=2 1293 B11R1.41 COCc1ccccc1CBr 34a_100009816955_200000210301 [0,1,1,0,0,0|1,0,1]=4 1294 B11R1.41 COCc1ccccc1CBr 7a_100009816955_200000210301 [0,1,1,0,0,0|1,0,1]=4 1295 B11R1.41 COCc1ccccc1CN 34a_100000743596_200000210301 [0,1,1,0,0,0|1,0,1]=4 1296 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [0,1,1,0,0,0|0,0,2]=4 1297 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,1,1,0,0,0|2,0,0]=4 1298 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,1,1,0,0,0|2,0,0]=4 1299 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,1,1,0,0,0|2,0,0]=4 1300 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,1,1,0,0,0|2,0,0]=4 1301 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,1,1,0,0,0|2,0,0]=4 1302 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,1,1,0,0,0|2,0,0]=4 1303 B11R1.41 COCc1ccccc1SC 34a_100000699167_200000210301 [0,1,1,0,0,0|2,0,0]=4 1304 B11R1.41 COCc1ccccc1SC 34a_100138415774_100000699184 [0,1,1,0,0,0|2,0,0]=4 1305 B11R1.41 COCc1ccccc1SC 62a_100011493684_200000210301 [0,1,1,0,0,0|2,0,0]=4 1306 B11R1.41 COCc1ccccc1SC 62a_200000210301_100011493684 [0,1,1,0,0,0|2,0,0]=4 1307 B11R1.41 COCc1ccccc1S[13CH3] 62a_100011493684_200025704644 [0,1,1,0,0,0|2,0,0]=4 1308 B11R1.41 COCc1ccccc1S[13CH3] 62a_200025704644_100011493684 [0,1,1,0,0,0|2,0,0]=4 1309 B11R1.41 COc1ccccc1CCO 34a_100000719421_200000210301 [0,1,1,0,0,0|2,0,0]=4 1310 B11R1.41 COc1ccccc1CCO 7a_100000719421_200000210301 [0,1,1,0,0,0|2,0,0]=4 1311 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,1,1,0,0,0|2,0,0]=4 1312 B11R1.41 CSCc1ccccc1C=O 62a_200000210301_200009853537 [0,1,1,0,0,0|0,1,0]=3 1313 B11R1.41 CSCc1ccccc1C=O 62a_200009853537_200000210301 [0,1,1,0,0,0|0,1,0]=3 1314 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [0,1,1,0,0,0|0,1,1]=4 1315 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [0,1,1,0,0,0|0,1,1]=4 1316 B11R1.41 CSc1ccccc1CCO 62a_100000731337_200000210301 [0,1,1,0,0,0|2,0,0]=4 1317 B11R1.41 CSc1ccccc1CCO 62a_200000210301_100000731337 [0,1,1,0,0,0|2,0,0]=4 1318 B11R1.41 CSc1ccccc1CO[13CH3] 34a_100000699167_200025704644 [0,1,1,0,0,0|2,0,0]=4 1319 B11R1.41 CSc1ccccc1NC=O 62a_200000210301_200020615051 [0,1,1,0,0,0|2,0,0]=4 1320 B11R1.41 CSc1ccccc1NC=O 62a_200020615051_200000210301 [0,1,1,0,0,0|2,0,0]=4 1321 B11R1.41 O=Cc1ccccc1SCF 62a_100000210073_100015361967 [0,1,1,0,0,0|1,0,0]=3 1322 B11R1.41 O=Cc1ccccc1SCF 62a_100015361967_100000210073 [0,1,1,0,0,0|1,0,0]=3 1323 B11R1.41 O=Cc1cccnc1SCF 62a_100009816751_100015361967 [0,1,1,0,0,0|2,0,0]=4 1324 B11R1.41 O=Cc1cccnc1SCF 62a_100015361967_100009816751 [0,1,1,0,0,0|2,0,0]=4 1325 B11R1.41 O=Cc1ccncc1SCF 62a_100011934409_100015361967 [0,1,1,0,0,0|2,0,0]=4 1326 B11R1.41 O=Cc1ccncc1SCF 62a_100015361967_100011934409 [0,1,1,0,0,0|2,0,0]=4 1327 B11R1.41 O=Cc1cnccc1SCF 62a_100000050567_100015361967 [0,1,1,0,0,0|2,0,0]=4 1328 B11R1.41 O=Cc1cnccc1SCF 62a_100015361967_100000050567 [0,1,1,0,0,0|2,0,0]=4 1329 B11R1.41 O=Cc1ncccc1SCF 62a_100011934733_100015361967 [0,1,1,0,0,0|2,0,0]=4 1330 B11R1.41 O=Cc1ncccc1SCF 62a_100015361967_100011934733 [0,1,1,0,0,0|2,0,0]=4 1331 B11R1.41 OCc1ccccc1NCF 34a_100000212039_100015361967 [0,1,1,0,0,0|1,0,1]=4 1332 B11R1.41 OCc1ccccc1OCF 34a_100011216872_100015361967 [0,1,1,0,0,0|1,0,1]=4 1333 B11R1.41 OCc1ccccc1SCF 62a_100000187465_100015361967 [0,1,1,0,0,0|1,0,1]=4 1334 B11R1.41 OCc1ccccc1SCF 62a_100015361967_100000187465 [0,1,1,0,0,0|1,0,1]=4 1335 B11R1.41 [13CH3]Nc1ccccc1CCO 2230a_100011215289_200025704644 [0,1,1,0,0,0|2,0,0]=4 1336 B11R1.41 [13CH3]Nc1ccccc1CCO 34a_100011215289_200025704644 [0,1,1,0,0,0|2,0,0]=4 1337 B11R1.41 [13CH3]OCc1ccccc1C#N 34a_200011269968_200025704644 [0,1,1,0,0,0|1,0,1]=4 1338 B11R1.41 [13CH3]OCc1ccccc1C#N 7a_200011269968_200025704644 [0,1,1,0,0,0|1,0,1]=4 1339 B11R1.41 [13CH3]OCc1ccccc1CBr 34a_100009816955_200025704644 [0,1,1,0,0,0|1,0,1]=4 1340 B11R1.41 [13CH3]OCc1ccccc1CBr 7a_100009816955_200025704644 [0,1,1,0,0,0|1,0,1]=4 1341 B11R1.41 [13CH3]OCc1ccccc1CN 34a_100000743596_200025704644 [0,1,1,0,0,0|1,0,1]=4 1342 B11R1.41 [13CH3]Oc1ccccc1CCO 34a_100000719421_200025704644 [0,1,1,0,0,0|2,0,0]=4 1343 B11R1.41 [13CH3]Oc1ccccc1CCO 7a_100000719421_200025704644 [0,1,1,0,0,0|2,0,0]=4 1344 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200009853537_200025704644 [0,1,1,0,0,0|0,1,0]=3 1345 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200025704644_200009853537 [0,1,1,0,0,0|0,1,0]=3 1346 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [0,1,1,0,0,0|0,1,1]=4 1347 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [0,1,1,0,0,0|0,1,1]=4 1348 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_100000731337_200025704644 [0,1,1,0,0,0|2,0,0]=4 1349 B11R1.41 [13CH3]Sc1ccccc1CCO 62a_200025704644_100000731337 [0,1,1,0,0,0|2,0,0]=4 1350 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200020615051_200025704644 [0,1,1,0,0,0|2,0,0]=4 1351 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200025704644_200020615051 [0,1,1,0,0,0|2,0,0]=4 1352 B11R1.53 C#Cc1ccccc1C(=O)C 1458a_100011243808_200000210301 [0,1,1,0,0,0|1,0,1]=4 1353 B11R1.53 C#Cc1ccccc1C(=O)[13CH3] 1458a_100011243808_200025704644 [0,1,1,0,0,0|1,0,1]=4 1354 B11R1.53 C=C(C)c1ccccc1C=O 271570a_100000694244_100000211189 [0,1,1,0,0,0|1,0,1]=4 1355 B11R1.53 C=C(C)c1ccccc1CC 271570a_100000694244_100011215823 [0,1,1,0,0,0|2,0,0]=4 1356 B11R1.53 C=C(C)c1ccccc1CN 271570a_100000694244_100000689332 [0,1,1,0,0,0|2,0,0]=4 1357 B11R1.53 C=C(C)c1ccccc1CO 271570a_100000694244_100000187465 [0,1,1,0,0,0|1,0,0]=3 1358 B11R1.53 C=C(C)c1cccnc1CO 271570a_100000694244_100011996772 [0,1,1,0,0,0|2,0,0]=4 1359 B11R1.53 C=C(C)c1ccncc1CO 271570a_100000694244_100000117392 [0,1,1,0,0,0|2,0,0]=4 1360 B11R1.53 C=C(C)c1cnccc1CO 271570a_100000694244_100009873359 [0,1,1,0,0,0|2,0,0]=4 1361 B11R1.53 C=C(C)c1ncccc1CO 271570a_100000694244_100000748726 [0,1,1,0,0,0|2,0,0]=4 1362 B11R1.53 C=Cc1ccccc1B(O)O 271570a_100011290941_100000693059 [0,1,1,0,0,0|2,0,0]=4 1363 B11R1.53 C=Cc1ccccc1C(=O)C 1458a_100011830265_200000210301 [0,1,1,0,0,0|1,0,1]=4 1364 B11R1.53 C=Cc1ccccc1C(=O)C 271570a_100011290941_100000751169 [0,1,1,0,0,0|1,0,1]=4 1365 B11R1.53 C=Cc1ccccc1C(=O)N 271570a_100011290941_100000162227 [0,1,1,0,0,0|1,0,1]=4 1366 B11R1.53 C=Cc1ccccc1C(=O)[13CH3] 1458a_100011830265_200025704644 [0,1,1,0,0,0|1,0,1]=4 1367 B11R1.53 C=Cc1ccccc1C(C)C 271570a_100011290941_100011218076 [0,1,1,0,0,0|2,0,0]=4 1368 B11R1.53 C=Cc1ccccc1C(C)N 271570a_100011290941_100000181357 [0,1,1,0,0,0|2,0,0]=4 1369 B11R1.53 C=Cc1ccccc1C(C)O 271570a_100011290941_100000702211 [0,1,1,0,0,0|1,0,0]=3 1370 B11R1.53 C=Cc1ccccc1C(F)F 271570a_100011290941_100010169824 [0,1,1,0,0,0|2,0,0]=4 1371 B11R1.53 C=Cc1cccnc1[C@H](C)O 271570a_100011290941_100013325542 [0,1,1,0,0,0|2,0,0]=4 1372 B11R1.53 C=Cc1ncccc1C(C)O 271570a_100011290941_100009865335 [0,1,1,0,0,0|2,0,0]=4 1373 B11R1.53 CC(=O)c1ccccc1C#N 1458a_100000742908_200000210301 [0,1,1,0,0,0|1,0,1]=4 1374 B11R1.53 CC(=O)c1ccccc1CO 1458a_100011301526_200000210301 [0,1,1,0,0,0|0,0,0]=2 1375 B11R1.53 CC(=O)c1ccccc1I=O 1458a_100000032414_200000210301 [0,1,1,0,0,0|1,0,1]=4 1376 B11R1.53 CC(=O)c1ccccc1S[13CH3] 62a_100000751169_200025704644 [0,1,1,0,0,0|2,0,0]=4 1377 B11R1.53 CC(O)c1ccccc1N[13CH3] 2230a_100011405641_200025704644 [0,1,1,0,0,0|2,0,0]=4 1378 B11R1.53 CC(O)c1ccccc1O[13CH3] 34a_200011232679_200025704644 [0,1,1,0,0,0|2,0,0]=4 1379 B11R1.53 CC(O)c1ccccc1O[13CH3] 7a_200011232679_200025704644 [0,1,1,0,0,0|2,0,0]=4 1380 B11R1.53 CC(O)c1ccccc1S[13CH3] 62a_100000702211_200025704644 [0,1,1,0,0,0|2,0,0]=4 1381 B11R1.53 CC(O)c1ccccc1S[13CH3] 62a_200025704644_100000702211 [0,1,1,0,0,0|2,0,0]=4 1382 B11R1.53 CCc1ccccc1C(=O)C 1458a_100000689120_200000210301 [0,1,1,0,0,0|1,0,0]=3 1383 B11R1.53 CCc1ccccc1C(=O)[13CH3] 1458a_100000689120_200025704644 [0,1,1,0,0,0|1,0,0]=3 1384 B11R1.53 CNc1ccccc1C(=O)N 34a_100000185089_200000210301 [0,1,1,0,0,0|2,0,0]=4 1385 B11R1.53 CNc1ccccc1C(C)O 2230a_100011405641_200000210301 [0,1,1,0,0,0|2,0,0]=4 1386 B11R1.53 COc1ccccc1C(=O)C 1458a_100000185835_200000210301 [0,1,1,0,0,0|2,0,0]=4 1387 B11R1.53 COc1ccccc1C(=O)N 34a_100000192804_200000210301 [0,1,1,0,0,0|2,0,0]=4 1388 B11R1.53 COc1ccccc1C(=O)N 7a_100000192804_200000210301 [0,1,1,0,0,0|2,0,0]=4 1389 B11R1.53 COc1ccccc1C(=O)[13CH3] 1458a_100000185835_200025704644 [0,1,1,0,0,0|2,0,0]=4 1390 B11R1.53 COc1ccccc1C(=O)[O-] 7a_100015234032_200000210301 [0,1,1,0,0,0|2,0,0]=4 1391 B11R1.53 COc1ccccc1C(C)O 34a_200011232679_200000210301 [0,1,1,0,0,0|2,0,0]=4 1392 B11R1.53 COc1ccccc1C(C)O 7a_200011232679_200000210301 [0,1,1,0,0,0|2,0,0]=4 1393 B11R1.53 CSc1ccccc1C(=O)C 1458a_100000183967_200000210301 [0,1,1,0,0,0|2,0,0]=4 1394 B11R1.53 CSc1ccccc1C(=O)C 62a_100000751169_200000210301 [0,1,1,0,0,0|2,0,0]=4 1395 B11R1.53 CSc1ccccc1C(=O)N 62a_100000162227_200000210301 [0,1,1,0,0,0|2,0,0]=4 1396 B11R1.53 CSc1ccccc1C(=O)N 62a_200000210301_100000162227 [0,1,1,0,0,0|2,0,0]=4 1397 B11R1.53 CSc1ccccc1C(=O)O 62a_200000210301_100000734275 [0,1,1,0,0,0|2,0,0]=4 1398 B11R1.53 CSc1ccccc1C(=O)O 62a_202125556159_200000210301 [0,1,1,0,0,0|2,0,0]=4 1399 B11R1.53 CSc1ccccc1C(=O)[13CH3] 1458a_100000183967_200025704644 [0,1,1,0,0,0|2,0,0]=4 1400 B11R1.53 CSc1ccccc1C(C)O 62a_100000702211_200000210301 [0,1,1,0,0,0|2,0,0]=4 1401 B11R1.53 CSc1ccccc1C(C)O 62a_200000210301_100000702211 [0,1,1,0,0,0|2,0,0]=4 1402 B11R1.53 [13CH3]C(=O)c1ccccc1C#N 1458a_100000742908_200025704644 [0,1,1,0,0,0|1,0,1]=4 1403 B11R1.53 [13CH3]C(=O)c1ccccc1CO 1458a_100011301526_200025704644 [0,1,1,0,0,0|0,0,0]=2 1404 B11R1.53 [13CH3]C(=O)c1ccccc1I=O 1458a_100000032414_200025704644 [0,1,1,0,0,0|1,0,1]=4 1405 B11R1.53 [13CH3]Nc1ccccc1C(=O)N 34a_100000185089_200025704644 [0,1,1,0,0,0|2,0,0]=4 1406 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 34a_100000192804_200025704644 [0,1,1,0,0,0|2,0,0]=4 1407 B11R1.53 [13CH3]Oc1ccccc1C(=O)N 7a_100000192804_200025704644 [0,1,1,0,0,0|2,0,0]=4 1408 B11R1.53 [13CH3]Oc1ccccc1C(=O)[O-] 7a_100015234032_200025704644 [0,1,1,0,0,0|2,0,0]=4 1409 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_100000162227_200025704644 [0,1,1,0,0,0|2,0,0]=4 1410 B11R1.53 [13CH3]Sc1ccccc1C(=O)N 62a_200025704644_100000162227 [0,1,1,0,0,0|2,0,0]=4 1411 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_200025704644_100000734275 [0,1,1,0,0,0|2,0,0]=4 1412 B11R1.53 [13CH3]Sc1ccccc1C(=O)O 62a_202125556159_200025704644 [0,1,1,0,0,0|2,0,0]=4 1413 B11R1.265 C=Cc1c(cccc1C=O)F 271570a_100011290941_100011998484 [0,1,1,0,0,0|1,0,1]=4 1414 B11R1.265 C=Cc1c(cccc1C=O)O 271570a_100011290941_100009816417 [0,1,1,0,0,0|1,0,1]=4 1415 B11R1.265 C=Cc1c(cccc1CC)C 271570a_100011290941_100000036235 [0,1,1,0,0,0|2,0,0]=4 1416 B11R1.265 C=Cc1c(cccc1CO)Br 271570a_100011290941_100010146604 [0,1,1,0,0,0|1,0,0]=3 1417 B11R1.265 C=Cc1c(cccc1CO)C 271570a_100011290941_100011659289 [0,1,1,0,0,0|1,0,0]=3 1418 B11R1.265 C=Cc1c(cccc1CO)F 271570a_100011290941_100000692438 [0,1,1,0,0,0|1,0,0]=3 1419 B11R1.265 C=Cc1cccc(c1C=O)C 271570a_100011290941_100000041122 [0,1,1,0,0,0|1,0,1]=4 1420 B11R1.265 C=Cc1cccc(c1C=O)Cl 271570a_100011290941_100010147682 [0,1,1,0,0,0|1,0,1]=4 1421 B11R1.265 C=Cc1cccc(c1C=O)F 271570a_100011290941_100000210083 [0,1,1,0,0,0|1,0,1]=4 1422 B11R1.265 C=Cc1cccc(c1C=O)N 271570a_100011290941_100010232536 [0,1,1,0,0,0|1,0,1]=4 1423 B11R1.265 C=Cc1cccc(c1C=O)O 271570a_100011290941_100009814793 [0,1,1,0,0,0|1,0,1]=4 1424 B11R1.265 C=Cc1cccc(c1CN)F 271570a_100011290941_100012349121 [0,1,1,0,0,0|2,0,0]=4 1425 B11R1.265 C=Cc1cccc(c1CO)F 271570a_100011290941_100012355691 [0,1,1,0,0,0|1,0,0]=3 1426 B11R1.265 C=Cc1cccc(c1CO)N 271570a_100011290941_100000747656 [0,1,1,0,0,0|1,0,0]=3 1427 B11R1.265 C=Cc1ccnc(c1CO)Cl 271570a_100011290941_100000047008 [0,1,1,0,0,0|2,0,0]=4 1428 B11R1.265 C=Cc1ccnc(c1CO)F 271570a_100011290941_100000050056 [0,1,1,0,0,0|2,0,0]=4 1429 B11R1.265 CNc1c(cccc1CO)C 34a_100011215590_200000210301 [0,1,1,0,0,0|2,0,0]=4 1430 B11R1.265 CNc1c(cccc1CO)Cl 34a_100012182729_200000210301 [0,1,1,0,0,0|2,0,0]=4 1431 B11R1.265 CNc1c(cccc1CO)F 34a_100000692437_200000210301 [0,1,1,0,0,0|2,0,0]=4 1432 B11R1.265 CNc1cccc(c1CO)Br 34a_100000747656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1433 B11R1.265 CNc1cccc(c1CO)Cl 34a_100011916388_200000210301 [0,1,1,0,0,0|2,0,0]=4 1434 B11R1.265 CNc1cccc(c1CO)F 34a_100011846719_200000210301 [0,1,1,0,0,0|2,0,0]=4 1435 B11R1.265 COc1c(cccc1C=O)O 271570a_203496583355_100000692592 [0,1,1,0,0,0|2,0,0]=4 1436 B11R1.265 COc1c(cccc1CO)F 34a_100011997349_200000210301 [0,1,1,0,0,0|2,0,0]=4 1437 B11R1.265 COc1c(cccc1CO)F 7a_100011997349_200000210301 [0,1,1,0,0,0|2,0,0]=4 1438 B11R1.265 COc1c(cccc1CO)O 271570a_203496583355_100000704359 [0,1,1,0,0,0|2,0,0]=4 1439 B11R1.265 COc1cccc(c1C=O)O 271570a_203496583355_100009814803 [0,1,1,0,0,0|2,0,0]=4 1440 B11R1.265 COc1cccc(c1CO)C 34a_200009874777_200000210301 [0,1,1,0,0,0|2,0,0]=4 1441 B11R1.265 COc1cccc(c1CO)C 7a_200009874777_200000210301 [0,1,1,0,0,0|2,0,0]=4 1442 B11R1.265 CSc1c(cccc1C=O)C 62a_100012186367_200000210301 [0,1,1,0,0,0|2,0,0]=4 1443 B11R1.265 CSc1c(cccc1C=O)C 62a_200000210301_100012186367 [0,1,1,0,0,0|2,0,0]=4 1444 B11R1.265 CSc1c(cccc1C=O)F 62a_100011934749_200000210301 [0,1,1,0,0,0|2,0,0]=4 1445 B11R1.265 CSc1c(cccc1C=O)F 62a_200000210301_100011934749 [0,1,1,0,0,0|2,0,0]=4 1446 B11R1.265 CSc1c(cccc1C=O)O 62a_100009816417_200000210301 [0,1,1,0,0,0|2,0,0]=4 1447 B11R1.265 CSc1c(cccc1C=O)O 62a_200000210301_100009816417 [0,1,1,0,0,0|2,0,0]=4 1448 B11R1.265 CSc1c(cccc1CO)Br 62a_100010146604_200000210301 [0,1,1,0,0,0|2,0,0]=4 1449 B11R1.265 CSc1c(cccc1CO)Br 62a_200000210301_100010146604 [0,1,1,0,0,0|2,0,0]=4 1450 B11R1.265 CSc1c(cccc1CO)C 62a_100011659289_200000210301 [0,1,1,0,0,0|2,0,0]=4 1451 B11R1.265 CSc1c(cccc1CO)C 62a_200000210301_100011659289 [0,1,1,0,0,0|2,0,0]=4 1452 B11R1.265 CSc1c(cccc1CO)F 62a_100012351117_200000210301 [0,1,1,0,0,0|2,0,0]=4 1453 B11R1.265 CSc1c(cccc1CO)F 62a_200000210301_100012351117 [0,1,1,0,0,0|2,0,0]=4 1454 B11R1.265 CSc1cccc(c1C=O)C 62a_100000041122_200000210301 [0,1,1,0,0,0|2,0,0]=4 1455 B11R1.265 CSc1cccc(c1C=O)C 62a_200000210301_100000041122 [0,1,1,0,0,0|2,0,0]=4 1456 B11R1.265 CSc1cccc(c1C=O)Cl 62a_100010147682_200000210301 [0,1,1,0,0,0|2,0,0]=4 1457 B11R1.265 CSc1cccc(c1C=O)Cl 62a_200000210301_100010147682 [0,1,1,0,0,0|2,0,0]=4 1458 B11R1.265 CSc1cccc(c1C=O)F 62a_100000210083_200000210301 [0,1,1,0,0,0|2,0,0]=4 1459 B11R1.265 CSc1cccc(c1C=O)F 62a_200000210301_100000210083 [0,1,1,0,0,0|2,0,0]=4 1460 B11R1.265 CSc1cccc(c1C=O)N 62a_100010232536_200000210301 [0,1,1,0,0,0|2,0,0]=4 1461 B11R1.265 CSc1cccc(c1C=O)O 62a_200000210301_100010193437 [0,1,1,0,0,0|2,0,0]=4 1462 B11R1.265 CSc1cccc(c1CO)F 62a_100012355691_200000210301 [0,1,1,0,0,0|2,0,0]=4 1463 B11R1.265 CSc1cccc(c1CO)F 62a_200000210301_100012355691 [0,1,1,0,0,0|2,0,0]=4 1464 B11R1.265 CSc1cccc(c1CO)N 62a_100000747656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1465 B11R1.265 CSc1cccc(c1CO)N 62a_200000210301_100000747656 [0,1,1,0,0,0|2,0,0]=4 1466 B11R1.265 Cc1cccc(c1C=O)S[13CH3] 62a_100000041122_200025704644 [0,1,1,0,0,0|2,0,0]=4 1467 B11R1.265 Cc1cccc(c1C=O)S[13CH3] 62a_200025704644_100000041122 [0,1,1,0,0,0|2,0,0]=4 1468 B11R1.265 Cc1cccc(c1CO)O[13CH3] 34a_200009874777_200025704644 [0,1,1,0,0,0|2,0,0]=4 1469 B11R1.265 Cc1cccc(c1CO)O[13CH3] 7a_200009874777_200025704644 [0,1,1,0,0,0|2,0,0]=4 1470 B11R1.265 Cc1cccc(c1N[13CH3])CO 34a_100011215590_200025704644 [0,1,1,0,0,0|2,0,0]=4 1471 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_100012186367_200025704644 [0,1,1,0,0,0|2,0,0]=4 1472 B11R1.265 Cc1cccc(c1S[13CH3])C=O 62a_200025704644_100012186367 [0,1,1,0,0,0|2,0,0]=4 1473 B11R1.265 Cc1cccc(c1S[13CH3])CO 62a_100011659289_200025704644 [0,1,1,0,0,0|2,0,0]=4 1474 B11R1.265 Cc1cccc(c1S[13CH3])CO 62a_200025704644_100011659289 [0,1,1,0,0,0|2,0,0]=4 1475 B11R1.265 N#Cc1c(cccc1C=O)O 271570a_203496583355_100000100183 [0,1,1,0,0,0|1,0,1]=4 1476 B11R1.265 [13CH3]Nc1c(cccc1CO)Cl 34a_100012182729_200025704644 [0,1,1,0,0,0|2,0,0]=4 1477 B11R1.265 [13CH3]Nc1c(cccc1CO)F 34a_100000692437_200025704644 [0,1,1,0,0,0|2,0,0]=4 1478 B11R1.265 [13CH3]Nc1cccc(c1CO)Br 34a_100000747656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1479 B11R1.265 [13CH3]Nc1cccc(c1CO)Cl 34a_100011916388_200025704644 [0,1,1,0,0,0|2,0,0]=4 1480 B11R1.265 [13CH3]Nc1cccc(c1CO)F 34a_100011846719_200025704644 [0,1,1,0,0,0|2,0,0]=4 1481 B11R1.265 [13CH3]Oc1c(cccc1CO)F 34a_100011997349_200025704644 [0,1,1,0,0,0|2,0,0]=4 1482 B11R1.265 [13CH3]Oc1c(cccc1CO)F 7a_100011997349_200025704644 [0,1,1,0,0,0|2,0,0]=4 1483 B11R1.265 [13CH3]Sc1c(cccc1C=O)F 62a_100011934749_200025704644 [0,1,1,0,0,0|2,0,0]=4 1484 B11R1.265 [13CH3]Sc1c(cccc1C=O)F 62a_200025704644_100011934749 [0,1,1,0,0,0|2,0,0]=4 1485 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_100009816417_200025704644 [0,1,1,0,0,0|2,0,0]=4 1486 B11R1.265 [13CH3]Sc1c(cccc1C=O)O 62a_200025704644_100009816417 [0,1,1,0,0,0|2,0,0]=4 1487 B11R1.265 [13CH3]Sc1c(cccc1CO)Br 62a_100010146604_200025704644 [0,1,1,0,0,0|2,0,0]=4 1488 B11R1.265 [13CH3]Sc1c(cccc1CO)Br 62a_200025704644_100010146604 [0,1,1,0,0,0|2,0,0]=4 1489 B11R1.265 [13CH3]Sc1c(cccc1CO)F 62a_100012351117_200025704644 [0,1,1,0,0,0|2,0,0]=4 1490 B11R1.265 [13CH3]Sc1c(cccc1CO)F 62a_200025704644_100012351117 [0,1,1,0,0,0|2,0,0]=4 1491 B11R1.265 [13CH3]Sc1cccc(c1C=O)Cl 62a_100010147682_200025704644 [0,1,1,0,0,0|2,0,0]=4 1492 B11R1.265 [13CH3]Sc1cccc(c1C=O)Cl 62a_200025704644_100010147682 [0,1,1,0,0,0|2,0,0]=4 1493 B11R1.265 [13CH3]Sc1cccc(c1C=O)F 62a_100000210083_200025704644 [0,1,1,0,0,0|2,0,0]=4 1494 B11R1.265 [13CH3]Sc1cccc(c1C=O)F 62a_200025704644_100000210083 [0,1,1,0,0,0|2,0,0]=4 1495 B11R1.265 [13CH3]Sc1cccc(c1C=O)N 62a_100010232536_200025704644 [0,1,1,0,0,0|2,0,0]=4 1496 B11R1.265 [13CH3]Sc1cccc(c1C=O)O 62a_200025704644_100010193437 [0,1,1,0,0,0|2,0,0]=4 1497 B11R1.265 [13CH3]Sc1cccc(c1CO)F 62a_100012355691_200025704644 [0,1,1,0,0,0|2,0,0]=4 1498 B11R1.265 [13CH3]Sc1cccc(c1CO)F 62a_200025704644_100012355691 [0,1,1,0,0,0|2,0,0]=4 1499 B11R1.265 [13CH3]Sc1cccc(c1CO)N 62a_100000747656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1500 B11R1.265 [13CH3]Sc1cccc(c1CO)N 62a_200025704644_100000747656 [0,1,1,0,0,0|2,0,0]=4 1501 B11R1.156 C=C(C)c1c(cccc1C)C 271570a_100000694244_100000033847 [0,1,1,0,0,0|2,0,0]=4 1502 B11R1.156 C=C(C)c1c(cccc1Cl)C 271570a_100000694244_100000043165 [0,1,1,0,0,0|2,0,0]=4 1503 B11R1.156 C=C(C)c1c(cccc1F)C 271570a_100000694244_100012349962 [0,1,1,0,0,0|2,0,0]=4 1504 B11R1.156 C=C(C)c1c(cccc1N)C 271570a_100000694244_100000684715 [0,1,1,0,0,0|2,0,0]=4 1505 B11R1.156 C=C(C)c1c(cccc1O)C 271570a_100000694244_100000686692 [0,1,1,0,0,0|2,0,0]=4 1506 B11R1.156 CC(=O)c1c(cccc1Br)Br 1458a_100000690891_200000210301 [0,1,1,0,0,0|2,0,0]=4 1507 B11R1.156 CC(=O)c1c(cccc1Br)C 1458a_100000701904_200000210301 [0,1,1,0,0,0|1,0,0]=3 1508 B11R1.156 CC(=O)c1c(cccc1Br)Cl 1458a_100011253703_200000210301 [0,1,1,0,0,0|2,0,0]=4 1509 B11R1.156 CC(=O)c1c(cccc1Br)F 1458a_100000752694_200000210301 [0,1,1,0,0,0|2,0,0]=4 1510 B11R1.156 CC(=O)c1c(cccc1Br)O 1458a_100011935254_200000210301 [0,1,1,0,0,0|2,0,0]=4 1511 B11R1.156 CC(=O)c1c(cccc1C)C 1458a_100000758298_200000210301 [0,1,1,0,0,0|1,0,0]=3 1512 B11R1.156 CC(=O)c1c(cccc1Cl)C 1458a_100000692601_200000210301 [0,1,1,0,0,0|1,0,0]=3 1513 B11R1.156 CC(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200000210301 [0,1,1,0,0,0|2,0,0]=4 1514 B11R1.156 CC(=O)c1c(cccc1Cl)F 1458a_100000210369_200000210301 [0,1,1,0,0,0|2,0,0]=4 1515 B11R1.156 CC(=O)c1c(cccc1Cl)O 1458a_100000745519_200000210301 [0,1,1,0,0,0|2,0,0]=4 1516 B11R1.156 CC(=O)c1c(cccc1F)C 1458a_100000762013_200000210301 [0,1,1,0,0,0|1,0,0]=3 1517 B11R1.156 CC(=O)c1c(cccc1F)F 1458a_100000210804_200000210301 [0,1,1,0,0,0|2,0,0]=4 1518 B11R1.156 CC(=O)c1c(cccc1F)O 1458a_100000763259_200000210301 [0,1,1,0,0,0|2,0,0]=4 1519 B11R1.156 CC(=O)c1c(cccc1F)O 271570a_203496583355_100012351873 [0,1,1,0,0,0|2,0,0]=4 1520 B11R1.156 CC(=O)c1c(cccc1I)Br 1458a_100010232521_200000210301 [0,1,1,0,0,0|2,0,0]=4 1521 B11R1.156 CC(=O)c1c(cccc1I)C 1458a_100000688020_200000210301 [0,1,1,0,0,0|1,0,0]=3 1522 B11R1.156 CC(=O)c1c(cccc1I)Cl 1458a_100000702859_200000210301 [0,1,1,0,0,0|2,0,0]=4 1523 B11R1.156 CC(=O)c1c(cccc1I)F 1458a_100000023732_200000210301 [0,1,1,0,0,0|2,0,0]=4 1524 B11R1.156 CC(=O)c1c(cccc1O)C 1458a_100011934116_200000210301 [0,1,1,0,0,0|1,0,0]=3 1525 B11R1.156 CC(=O)c1c(cccc1O)O 1458a_100000755285_200000210301 [0,1,1,0,0,0|2,0,0]=4 1526 B11R1.156 CC(=O)c1c(cccc1O)O 271570a_203496583355_100010174959 [0,1,1,0,0,0|2,0,0]=4 1527 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Br 1458a_100000701904_200025704644 [0,1,1,0,0,0|1,0,0]=3 1528 B11R1.156 Cc1cccc(c1C(=O)[13CH3])C 1458a_100000758298_200025704644 [0,1,1,0,0,0|1,0,0]=3 1529 B11R1.156 Cc1cccc(c1C(=O)[13CH3])Cl 1458a_100000692601_200025704644 [0,1,1,0,0,0|1,0,0]=3 1530 B11R1.156 Cc1cccc(c1C(=O)[13CH3])F 1458a_100000762013_200025704644 [0,1,1,0,0,0|1,0,0]=3 1531 B11R1.156 Cc1cccc(c1C(=O)[13CH3])I 1458a_100000688020_200025704644 [0,1,1,0,0,0|1,0,0]=3 1532 B11R1.156 Cc1cccc(c1C(=O)[13CH3])O 1458a_100011934116_200025704644 [0,1,1,0,0,0|1,0,0]=3 1533 B11R1.156 NC(=O)c1c(cccc1Cl)O 271570a_203496583355_100010147686 [0,1,1,0,0,0|2,0,0]=4 1534 B11R1.156 NC(=O)c1c(cccc1F)O 271570a_203496583355_100011219063 [0,1,1,0,0,0|2,0,0]=4 1535 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Br 1458a_100000690891_200025704644 [0,1,1,0,0,0|2,0,0]=4 1536 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)Cl 1458a_100011253703_200025704644 [0,1,1,0,0,0|2,0,0]=4 1537 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)F 1458a_100000752694_200025704644 [0,1,1,0,0,0|2,0,0]=4 1538 B11R1.156 [13CH3]C(=O)c1c(cccc1Br)O 1458a_100011935254_200025704644 [0,1,1,0,0,0|2,0,0]=4 1539 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)Cl 1458a_100000210656_200025704644 [0,1,1,0,0,0|2,0,0]=4 1540 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)F 1458a_100000210369_200025704644 [0,1,1,0,0,0|2,0,0]=4 1541 B11R1.156 [13CH3]C(=O)c1c(cccc1Cl)O 1458a_100000745519_200025704644 [0,1,1,0,0,0|2,0,0]=4 1542 B11R1.156 [13CH3]C(=O)c1c(cccc1F)F 1458a_100000210804_200025704644 [0,1,1,0,0,0|2,0,0]=4 1543 B11R1.156 [13CH3]C(=O)c1c(cccc1F)O 1458a_100000763259_200025704644 [0,1,1,0,0,0|2,0,0]=4 1544 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Br 1458a_100010232521_200025704644 [0,1,1,0,0,0|2,0,0]=4 1545 B11R1.156 [13CH3]C(=O)c1c(cccc1I)Cl 1458a_100000702859_200025704644 [0,1,1,0,0,0|2,0,0]=4 1546 B11R1.156 [13CH3]C(=O)c1c(cccc1I)F 1458a_100000023732_200025704644 [0,1,1,0,0,0|2,0,0]=4 1547 B11R1.156 [13CH3]C(=O)c1c(cccc1O)O 1458a_100000755285_200025704644 [0,1,1,0,0,0|2,0,0]=4 1548 B11R1.159 C=C(C)c1cccc(c1C)Br 271570a_100000694244_100012353703 [0,1,1,0,0,0|2,0,0]=4 1549 B11R1.159 C=C(C)c1cccc(c1C)C 271570a_100000694244_100011214922 [0,1,1,0,0,0|2,0,0]=4 1550 B11R1.159 C=C(C)c1cccc(c1C)Cl 271570a_100000694244_100000726075 [0,1,1,0,0,0|2,0,0]=4 1551 B11R1.159 C=C(C)c1cccc(c1C)F 271570a_100000694244_100011216893 [0,1,1,0,0,0|2,0,0]=4 1552 B11R1.159 C=C(C)c1cccc(c1C)N 271570a_100000694244_100000761887 [0,1,1,0,0,0|2,0,0]=4 1553 B11R1.159 C=C(C)c1cccc(c1C)O 271570a_100000694244_100012002258 [0,1,1,0,0,0|2,0,0]=4 1554 B11R1.159 CC(=O)c1cccc(c1Br)Br 1458a_100012360534_200000210301 [0,1,1,0,0,0|2,0,0]=4 1555 B11R1.159 CC(=O)c1cccc(c1Br)C 1458a_100000692419_200000210301 [0,1,1,0,0,0|2,0,0]=4 1556 B11R1.159 CC(=O)c1cccc(c1Br)Cl 1458a_100012339722_200000210301 [0,1,1,0,0,0|2,0,0]=4 1557 B11R1.159 CC(=O)c1cccc(c1Br)F 1458a_100011217547_200000210301 [0,1,1,0,0,0|2,0,0]=4 1558 B11R1.159 CC(=O)c1cccc(c1Br)I 1458a_100010232522_200000210301 [0,1,1,0,0,0|2,0,0]=4 1559 B11R1.159 CC(=O)c1cccc(c1Br)O 1458a_100010230362_200000210301 [0,1,1,0,0,0|2,0,0]=4 1560 B11R1.159 CC(=O)c1cccc(c1C)Br 1458a_100000760464_200000210301 [0,1,1,0,0,0|1,0,0]=3 1561 B11R1.159 CC(=O)c1cccc(c1C)C 1458a_100000183679_200000210301 [0,1,1,0,0,0|1,0,0]=3 1562 B11R1.159 CC(=O)c1cccc(c1C)Cl 1458a_100000690184_200000210301 [0,1,1,0,0,0|1,0,0]=3 1563 B11R1.159 CC(=O)c1cccc(c1C)F 1458a_100011218272_200000210301 [0,1,1,0,0,0|1,0,0]=3 1564 B11R1.159 CC(=O)c1cccc(c1C)I 1458a_100000751865_200000210301 [0,1,1,0,0,0|1,0,0]=3 1565 B11R1.159 CC(=O)c1cccc(c1C)O 1458a_100000766327_200000210301 [0,1,1,0,0,0|1,0,0]=3 1566 B11R1.159 CC(=O)c1cccc(c1C)O 271570a_203496583355_100012706834 [0,1,1,0,0,0|1,0,0]=3 1567 B11R1.159 CC(=O)c1cccc(c1Cl)Br 1458a_100000760540_200000210301 [0,1,1,0,0,0|2,0,0]=4 1568 B11R1.159 CC(=O)c1cccc(c1Cl)C 1458a_100000693142_200000210301 [0,1,1,0,0,0|2,0,0]=4 1569 B11R1.159 CC(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200000210301 [0,1,1,0,0,0|2,0,0]=4 1570 B11R1.159 CC(=O)c1cccc(c1Cl)F 1458a_100000759904_200000210301 [0,1,1,0,0,0|2,0,0]=4 1571 B11R1.159 CC(=O)c1cccc(c1Cl)I 1458a_100010176783_200000210301 [0,1,1,0,0,0|2,0,0]=4 1572 B11R1.159 CC(=O)c1cccc(c1Cl)O 1458a_100000092362_200000210301 [0,1,1,0,0,0|2,0,0]=4 1573 B11R1.159 CC(=O)c1cccc(c1F)Br 1458a_100000756403_200000210301 [0,1,1,0,0,0|2,0,0]=4 1574 B11R1.159 CC(=O)c1cccc(c1F)C 1458a_100000766181_200000210301 [0,1,1,0,0,0|2,0,0]=4 1575 B11R1.159 CC(=O)c1cccc(c1F)Cl 1458a_100000688816_200000210301 [0,1,1,0,0,0|2,0,0]=4 1576 B11R1.159 CC(=O)c1cccc(c1F)F 1458a_100000748134_200000210301 [0,1,1,0,0,0|2,0,0]=4 1577 B11R1.159 CC(=O)c1cccc(c1F)I 1458a_100010185205_200000210301 [0,1,1,0,0,0|2,0,0]=4 1578 B11R1.159 CC(=O)c1cccc(c1F)O 1458a_100000037433_200000210301 [0,1,1,0,0,0|2,0,0]=4 1579 B11R1.159 CC(=O)c1cccc(c1F)O 271570a_203496583355_100012355707 [0,1,1,0,0,0|2,0,0]=4 1580 B11R1.159 CC(=O)c1cccc(c1I)Br 1458a_100000688019_200000210301 [0,1,1,0,0,0|2,0,0]=4 1581 B11R1.159 CC(=O)c1cccc(c1I)C 1458a_100000739377_200000210301 [0,1,1,0,0,0|2,0,0]=4 1582 B11R1.159 CC(=O)c1cccc(c1I)Cl 1458a_100010176784_200000210301 [0,1,1,0,0,0|2,0,0]=4 1583 B11R1.159 CC(=O)c1cccc(c1I)F 1458a_100000690930_200000210301 [0,1,1,0,0,0|2,0,0]=4 1584 B11R1.159 CC(=O)c1cccc(c1I)O 1458a_100010084636_200000210301 [0,1,1,0,0,0|2,0,0]=4 1585 B11R1.159 CC(=O)c1cccc(c1O)Br 1458a_100000752940_200000210301 [0,1,1,0,0,0|2,0,0]=4 1586 B11R1.159 CC(=O)c1cccc(c1O)C 1458a_100000183896_200000210301 [0,1,1,0,0,0|2,0,0]=4 1587 B11R1.159 CC(=O)c1cccc(c1O)Cl 1458a_100000742801_200000210301 [0,1,1,0,0,0|2,0,0]=4 1588 B11R1.159 CC(=O)c1cccc(c1O)F 1458a_100011217230_200000210301 [0,1,1,0,0,0|2,0,0]=4 1589 B11R1.159 CC(=O)c1cccc(c1O)F 271570a_203496583355_100012362612 [0,1,1,0,0,0|2,0,0]=4 1590 B11R1.159 CC(=O)c1cccc(c1O)O 1458a_100000690420_200000210301 [0,1,1,0,0,0|2,0,0]=4 1591 B11R1.159 CC(=O)c1cccc(c1O)O 271570a_203496583355_100009815558 [0,1,1,0,0,0|2,0,0]=4 1592 B11R1.159 Cc1c(cccc1B(O)O)O 271570a_203496583355_100000724322 [0,1,1,0,0,0|1,0,1]=4 1593 B11R1.159 Cc1c(cccc1C(=O)N)O 271570a_203496583355_200012298201 [0,1,1,0,0,0|1,0,0]=3 1594 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Br 1458a_100000760464_200025704644 [0,1,1,0,0,0|1,0,0]=3 1595 B11R1.159 Cc1c(cccc1C(=O)[13CH3])Cl 1458a_100000690184_200025704644 [0,1,1,0,0,0|1,0,0]=3 1596 B11R1.159 Cc1c(cccc1C(=O)[13CH3])F 1458a_100011218272_200025704644 [0,1,1,0,0,0|1,0,0]=3 1597 B11R1.159 Cc1c(cccc1C(=O)[13CH3])I 1458a_100000751865_200025704644 [0,1,1,0,0,0|1,0,0]=3 1598 B11R1.159 Cc1c(cccc1C(=O)[13CH3])O 1458a_100000766327_200025704644 [0,1,1,0,0,0|1,0,0]=3 1599 B11R1.159 Cc1cccc(c1Br)C(=O)[13CH3] 1458a_100000692419_200025704644 [0,1,1,0,0,0|2,0,0]=4 1600 B11R1.159 Cc1cccc(c1C)C(=O)[13CH3] 1458a_100000183679_200025704644 [0,1,1,0,0,0|1,0,0]=3 1601 B11R1.159 Cc1cccc(c1Cl)C(=O)[13CH3] 1458a_100000693142_200025704644 [0,1,1,0,0,0|2,0,0]=4 1602 B11R1.159 Cc1cccc(c1F)C(=O)[13CH3] 1458a_100000766181_200025704644 [0,1,1,0,0,0|2,0,0]=4 1603 B11R1.159 Cc1cccc(c1I)C(=O)[13CH3] 1458a_100000739377_200025704644 [0,1,1,0,0,0|2,0,0]=4 1604 B11R1.159 Cc1cccc(c1O)C(=O)N 271570a_203496583355_200011409216 [0,1,1,0,0,0|2,0,0]=4 1605 B11R1.159 Cc1cccc(c1O)C(=O)[13CH3] 1458a_100000183896_200025704644 [0,1,1,0,0,0|2,0,0]=4 1606 B11R1.159 NC(=O)c1cccc(c1F)O 271570a_203496583355_100012351131 [0,1,1,0,0,0|2,0,0]=4 1607 B11R1.159 NC(=O)c1cccc(c1N)O 271570a_203496583355_100010144993 [0,1,1,0,0,0|2,0,0]=4 1608 B11R1.159 NC(=O)c1cccc(c1O)F 271570a_203496583355_200012351544 [0,1,1,0,0,0|2,0,0]=4 1609 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Br 1458a_100012360534_200025704644 [0,1,1,0,0,0|2,0,0]=4 1610 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)Cl 1458a_100012339722_200025704644 [0,1,1,0,0,0|2,0,0]=4 1611 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)F 1458a_100011217547_200025704644 [0,1,1,0,0,0|2,0,0]=4 1612 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)I 1458a_100010232522_200025704644 [0,1,1,0,0,0|2,0,0]=4 1613 B11R1.159 [13CH3]C(=O)c1cccc(c1Br)O 1458a_100010230362_200025704644 [0,1,1,0,0,0|2,0,0]=4 1614 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Br 1458a_100000760540_200025704644 [0,1,1,0,0,0|2,0,0]=4 1615 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)Cl 1458a_100000183631_200025704644 [0,1,1,0,0,0|2,0,0]=4 1616 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)F 1458a_100000759904_200025704644 [0,1,1,0,0,0|2,0,0]=4 1617 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)I 1458a_100010176783_200025704644 [0,1,1,0,0,0|2,0,0]=4 1618 B11R1.159 [13CH3]C(=O)c1cccc(c1Cl)O 1458a_100000092362_200025704644 [0,1,1,0,0,0|2,0,0]=4 1619 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Br 1458a_100000756403_200025704644 [0,1,1,0,0,0|2,0,0]=4 1620 B11R1.159 [13CH3]C(=O)c1cccc(c1F)Cl 1458a_100000688816_200025704644 [0,1,1,0,0,0|2,0,0]=4 1621 B11R1.159 [13CH3]C(=O)c1cccc(c1F)F 1458a_100000748134_200025704644 [0,1,1,0,0,0|2,0,0]=4 1622 B11R1.159 [13CH3]C(=O)c1cccc(c1F)I 1458a_100010185205_200025704644 [0,1,1,0,0,0|2,0,0]=4 1623 B11R1.159 [13CH3]C(=O)c1cccc(c1F)O 1458a_100000037433_200025704644 [0,1,1,0,0,0|2,0,0]=4 1624 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Br 1458a_100000688019_200025704644 [0,1,1,0,0,0|2,0,0]=4 1625 B11R1.159 [13CH3]C(=O)c1cccc(c1I)Cl 1458a_100010176784_200025704644 [0,1,1,0,0,0|2,0,0]=4 1626 B11R1.159 [13CH3]C(=O)c1cccc(c1I)F 1458a_100000690930_200025704644 [0,1,1,0,0,0|2,0,0]=4 1627 B11R1.159 [13CH3]C(=O)c1cccc(c1I)O 1458a_100010084636_200025704644 [0,1,1,0,0,0|2,0,0]=4 1628 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Br 1458a_100000752940_200025704644 [0,1,1,0,0,0|2,0,0]=4 1629 B11R1.159 [13CH3]C(=O)c1cccc(c1O)Cl 1458a_100000742801_200025704644 [0,1,1,0,0,0|2,0,0]=4 1630 B11R1.159 [13CH3]C(=O)c1cccc(c1O)F 1458a_100011217230_200025704644 [0,1,1,0,0,0|2,0,0]=4 1631 B11R1.159 [13CH3]C(=O)c1cccc(c1O)O 1458a_100000690420_200025704644 [0,1,1,0,0,0|2,0,0]=4 1632 B11R1.166 C=C(C)c1ccc(cc1C)Br 271570a_100000694244_100000701812 [0,1,1,0,0,0|2,0,0]=4 1633 B11R1.166 C=C(C)c1ccc(cc1C)C 271570a_100000694244_100011217332 [0,1,1,0,0,0|2,0,0]=4 1634 B11R1.166 C=C(C)c1ccc(cc1C)Cl 271570a_100000694244_100011219607 [0,1,1,0,0,0|2,0,0]=4 1635 B11R1.166 C=C(C)c1ccc(cc1C)F 271570a_100000694244_100011205405 [0,1,1,0,0,0|2,0,0]=4 1636 B11R1.166 C=C(C)c1ccc(cc1C)N 271570a_100000694244_100000210723 [0,1,1,0,0,0|2,0,0]=4 1637 B11R1.166 C=C(C)c1ccc(cc1C)O 271570a_100000694244_100000729255 [0,1,1,0,0,0|2,0,0]=4 1638 B11R1.166 CC(=O)c1ccc(cc1Br)Br 1458a_100000762965_200000210301 [0,1,1,0,0,0|2,0,0]=4 1639 B11R1.166 CC(=O)c1ccc(cc1Br)C 1458a_100000685072_200000210301 [0,1,1,0,0,0|2,0,0]=4 1640 B11R1.166 CC(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200000210301 [0,1,1,0,0,0|2,0,0]=4 1641 B11R1.166 CC(=O)c1ccc(cc1Br)F 1458a_100000212304_200000210301 [0,1,1,0,0,0|2,0,0]=4 1642 B11R1.166 CC(=O)c1ccc(cc1Br)I 1458a_100012360512_200000210301 [0,1,1,0,0,0|2,0,0]=4 1643 B11R1.166 CC(=O)c1ccc(cc1Br)O 1458a_100012344906_200000210301 [0,1,1,0,0,0|2,0,0]=4 1644 B11R1.166 CC(=O)c1ccc(cc1C)Br 1458a_100000741311_200000210301 [0,1,1,0,0,0|1,0,0]=3 1645 B11R1.166 CC(=O)c1ccc(cc1C)C 1458a_100000211164_200000210301 [0,1,1,0,0,0|1,0,0]=3 1646 B11R1.166 CC(=O)c1ccc(cc1C)Cl 1458a_100000688705_200000210301 [0,1,1,0,0,0|1,0,0]=3 1647 B11R1.166 CC(=O)c1ccc(cc1C)F 1458a_100000686989_200000210301 [0,1,1,0,0,0|1,0,0]=3 1648 B11R1.166 CC(=O)c1ccc(cc1C)I 1458a_100010189873_200000210301 [0,1,1,0,0,0|1,0,0]=3 1649 B11R1.166 CC(=O)c1ccc(cc1C)O 1458a_100000692822_200000210301 [0,1,1,0,0,0|1,0,0]=3 1650 B11R1.166 CC(=O)c1ccc(cc1C)O 271570a_203496583355_100012360112 [0,1,1,0,0,0|1,0,0]=3 1651 B11R1.166 CC(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200000210301 [0,1,1,0,0,0|2,0,0]=4 1652 B11R1.166 CC(=O)c1ccc(cc1Cl)C 1458a_100000766932_200000210301 [0,1,1,0,0,0|2,0,0]=4 1653 B11R1.166 CC(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200000210301 [0,1,1,0,0,0|2,0,0]=4 1654 B11R1.166 CC(=O)c1ccc(cc1Cl)F 1458a_100000211397_200000210301 [0,1,1,0,0,0|2,0,0]=4 1655 B11R1.166 CC(=O)c1ccc(cc1Cl)I 1458a_100000751301_200000210301 [0,1,1,0,0,0|2,0,0]=4 1656 B11R1.166 CC(=O)c1ccc(cc1Cl)O 1458a_100000702456_200000210301 [0,1,1,0,0,0|2,0,0]=4 1657 B11R1.166 CC(=O)c1ccc(cc1F)Br 1458a_100000214689_200000210301 [0,1,1,0,0,0|2,0,0]=4 1658 B11R1.166 CC(=O)c1ccc(cc1F)C 1458a_100000766033_200000210301 [0,1,1,0,0,0|2,0,0]=4 1659 B11R1.166 CC(=O)c1ccc(cc1F)Cl 1458a_100000212326_200000210301 [0,1,1,0,0,0|2,0,0]=4 1660 B11R1.166 CC(=O)c1ccc(cc1F)F 1458a_100000211022_200000210301 [0,1,1,0,0,0|2,0,0]=4 1661 B11R1.166 CC(=O)c1ccc(cc1F)I 1458a_100000037189_200000210301 [0,1,1,0,0,0|2,0,0]=4 1662 B11R1.166 CC(=O)c1ccc(cc1F)O 1458a_100000689029_200000210301 [0,1,1,0,0,0|2,0,0]=4 1663 B11R1.166 CC(=O)c1ccc(cc1F)O 271570a_203496583355_100000690205 [0,1,1,0,0,0|2,0,0]=4 1664 B11R1.166 CC(=O)c1ccc(cc1I)Br 1458a_100000751167_200000210301 [0,1,1,0,0,0|2,0,0]=4 1665 B11R1.166 CC(=O)c1ccc(cc1I)C 1458a_100009999607_200000210301 [0,1,1,0,0,0|2,0,0]=4 1666 B11R1.166 CC(=O)c1ccc(cc1I)Cl 1458a_100000739380_200000210301 [0,1,1,0,0,0|2,0,0]=4 1667 B11R1.166 CC(=O)c1ccc(cc1I)F 1458a_100000739341_200000210301 [0,1,1,0,0,0|2,0,0]=4 1668 B11R1.166 CC(=O)c1ccc(cc1N)O 271570a_203496583355_100011590516 [0,1,1,0,0,0|2,0,0]=4 1669 B11R1.166 CC(=O)c1ccc(cc1O)Br 1458a_100000744433_200000210301 [0,1,1,0,0,0|2,0,0]=4 1670 B11R1.166 CC(=O)c1ccc(cc1O)C 1458a_100000212137_200000210301 [0,1,1,0,0,0|2,0,0]=4 1671 B11R1.166 CC(=O)c1ccc(cc1O)C 271570a_203496583355_100012353930 [0,1,1,0,0,0|2,0,0]=4 1672 B11R1.166 CC(=O)c1ccc(cc1O)Cl 1458a_100000188622_200000210301 [0,1,1,0,0,0|2,0,0]=4 1673 B11R1.166 CC(=O)c1ccc(cc1O)F 1458a_100000746061_200000210301 [0,1,1,0,0,0|2,0,0]=4 1674 B11R1.166 CC(=O)c1ccc(cc1O)F 271570a_203496583355_100000686192 [0,1,1,0,0,0|2,0,0]=4 1675 B11R1.166 CC(=O)c1ccc(cc1O)I 1458a_100000091984_200000210301 [0,1,1,0,0,0|2,0,0]=4 1676 B11R1.166 CC(=O)c1ccc(cc1O)O 1458a_100000212172_200000210301 [0,1,1,0,0,0|2,0,0]=4 1677 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100000188348 [0,1,1,0,0,0|2,0,0]=4 1678 B11R1.166 CC(=O)c1ccc(cc1O)O 271570a_203496583355_100012340537 [0,1,1,0,0,0|2,0,0]=4 1679 B11R1.166 Cc1cc(ccc1B(O)O)O 271570a_203496583355_100010074995 [0,1,1,0,0,0|1,0,1]=4 1680 B11R1.166 Cc1cc(ccc1C(=O)N)O 271570a_203496583355_100011327924 [0,1,1,0,0,0|1,0,0]=3 1681 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Br 1458a_100000741311_200025704644 [0,1,1,0,0,0|1,0,0]=3 1682 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])Cl 1458a_100000688705_200025704644 [0,1,1,0,0,0|1,0,0]=3 1683 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])F 1458a_100000686989_200025704644 [0,1,1,0,0,0|1,0,0]=3 1684 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])I 1458a_100010189873_200025704644 [0,1,1,0,0,0|1,0,0]=3 1685 B11R1.166 Cc1cc(ccc1C(=O)[13CH3])O 1458a_100000692822_200025704644 [0,1,1,0,0,0|1,0,0]=3 1686 B11R1.166 Cc1cc(ncc1C(=O)N)O 271570a_203496583355_200134614278 [0,1,1,0,0,0|2,0,0]=4 1687 B11R1.166 Cc1ccc(c(c1)Br)C(=O)[13CH3] 1458a_100000685072_200025704644 [0,1,1,0,0,0|2,0,0]=4 1688 B11R1.166 Cc1ccc(c(c1)C)C(=O)[13CH3] 1458a_100000211164_200025704644 [0,1,1,0,0,0|1,0,0]=3 1689 B11R1.166 Cc1ccc(c(c1)Cl)C(=O)[13CH3] 1458a_100000766932_200025704644 [0,1,1,0,0,0|2,0,0]=4 1690 B11R1.166 Cc1ccc(c(c1)F)C(=O)[13CH3] 1458a_100000766033_200025704644 [0,1,1,0,0,0|2,0,0]=4 1691 B11R1.166 Cc1ccc(c(c1)I)C(=O)[13CH3] 1458a_100009999607_200025704644 [0,1,1,0,0,0|2,0,0]=4 1692 B11R1.166 Cc1ccc(c(c1)O)C(=O)[13CH3] 1458a_100000212137_200025704644 [0,1,1,0,0,0|2,0,0]=4 1693 B11R1.166 NC(=O)c1ccc(cc1Br)O 271570a_203496583355_200010146565 [0,1,1,0,0,0|2,0,0]=4 1694 B11R1.166 NC(=O)c1ccc(cc1F)O 271570a_203496583355_100000216903 [0,1,1,0,0,0|2,0,0]=4 1695 B11R1.166 NC(=O)c1ccc(cc1N)O 271570a_203496583355_100012349972 [0,1,1,0,0,0|2,0,0]=4 1696 B11R1.166 NC(=O)c1ccc(cc1O)Br 271570a_203496583355_100009815748 [0,1,1,0,0,0|2,0,0]=4 1697 B11R1.166 NC(=O)c1ccc(cc1O)F 271570a_203496583355_100000206404 [0,1,1,0,0,0|2,0,0]=4 1698 B11R1.166 NC(=O)c1ccc(cc1O)O 271570a_203496583355_100011550861 [0,1,1,0,0,0|2,0,0]=4 1699 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Br 1458a_100000762965_200025704644 [0,1,1,0,0,0|2,0,0]=4 1700 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)Cl 1458a_100000766353_200025704644 [0,1,1,0,0,0|2,0,0]=4 1701 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)F 1458a_100000212304_200025704644 [0,1,1,0,0,0|2,0,0]=4 1702 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)I 1458a_100012360512_200025704644 [0,1,1,0,0,0|2,0,0]=4 1703 B11R1.166 [13CH3]C(=O)c1ccc(cc1Br)O 1458a_100012344906_200025704644 [0,1,1,0,0,0|2,0,0]=4 1704 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Br 1458a_100000741628_200025704644 [0,1,1,0,0,0|2,0,0]=4 1705 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)Cl 1458a_100000185840_200025704644 [0,1,1,0,0,0|2,0,0]=4 1706 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)F 1458a_100000211397_200025704644 [0,1,1,0,0,0|2,0,0]=4 1707 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)I 1458a_100000751301_200025704644 [0,1,1,0,0,0|2,0,0]=4 1708 B11R1.166 [13CH3]C(=O)c1ccc(cc1Cl)O 1458a_100000702456_200025704644 [0,1,1,0,0,0|2,0,0]=4 1709 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Br 1458a_100000214689_200025704644 [0,1,1,0,0,0|2,0,0]=4 1710 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)Cl 1458a_100000212326_200025704644 [0,1,1,0,0,0|2,0,0]=4 1711 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)F 1458a_100000211022_200025704644 [0,1,1,0,0,0|2,0,0]=4 1712 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)I 1458a_100000037189_200025704644 [0,1,1,0,0,0|2,0,0]=4 1713 B11R1.166 [13CH3]C(=O)c1ccc(cc1F)O 1458a_100000689029_200025704644 [0,1,1,0,0,0|2,0,0]=4 1714 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Br 1458a_100000751167_200025704644 [0,1,1,0,0,0|2,0,0]=4 1715 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)Cl 1458a_100000739380_200025704644 [0,1,1,0,0,0|2,0,0]=4 1716 B11R1.166 [13CH3]C(=O)c1ccc(cc1I)F 1458a_100000739341_200025704644 [0,1,1,0,0,0|2,0,0]=4 1717 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Br 1458a_100000744433_200025704644 [0,1,1,0,0,0|2,0,0]=4 1718 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)Cl 1458a_100000188622_200025704644 [0,1,1,0,0,0|2,0,0]=4 1719 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)F 1458a_100000746061_200025704644 [0,1,1,0,0,0|2,0,0]=4 1720 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)I 1458a_100000091984_200025704644 [0,1,1,0,0,0|2,0,0]=4 1721 B11R1.166 [13CH3]C(=O)c1ccc(cc1O)O 1458a_100000212172_200025704644 [0,1,1,0,0,0|2,0,0]=4 1722 B11R1.167 C=C(C)c1cc(ccc1C)Br 271570a_100000694244_100011344865 [0,1,1,0,0,0|2,0,0]=4 1723 B11R1.167 C=C(C)c1cc(ccc1C)C 271570a_100000694244_100000210833 [0,1,1,0,0,0|2,0,0]=4 1724 B11R1.167 C=C(C)c1cc(ccc1C)Cl 271570a_100000694244_100011263213 [0,1,1,0,0,0|2,0,0]=4 1725 B11R1.167 C=C(C)c1cc(ccc1C)F 271570a_100000694244_100011218078 [0,1,1,0,0,0|2,0,0]=4 1726 B11R1.167 C=C(C)c1cc(ccc1C)N 271570a_100000694244_100000736455 [0,1,1,0,0,0|2,0,0]=4 1727 B11R1.167 C=C(C)c1cc(ccc1C)O 271570a_100000694244_100011380479 [0,1,1,0,0,0|2,0,0]=4 1728 B11R1.167 CC(=O)c1cc(ccc1Br)Br 1458a_100000690610_200000210301 [0,1,1,0,0,0|2,0,0]=4 1729 B11R1.167 CC(=O)c1cc(ccc1Br)C 1458a_100000689033_200000210301 [0,1,1,0,0,0|2,0,0]=4 1730 B11R1.167 CC(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200000210301 [0,1,1,0,0,0|2,0,0]=4 1731 B11R1.167 CC(=O)c1cc(ccc1Br)F 1458a_100000212315_200000210301 [0,1,1,0,0,0|2,0,0]=4 1732 B11R1.167 CC(=O)c1cc(ccc1Br)I 1458a_100000698340_200000210301 [0,1,1,0,0,0|2,0,0]=4 1733 B11R1.167 CC(=O)c1cc(ccc1Br)O 1458a_100012352043_200000210301 [0,1,1,0,0,0|2,0,0]=4 1734 B11R1.167 CC(=O)c1cc(ccc1C)Br 1458a_100000759961_200000210301 [0,1,1,0,0,0|1,0,0]=3 1735 B11R1.167 CC(=O)c1cc(ccc1C)C 1458a_100000195421_200000210301 [0,1,1,0,0,0|1,0,0]=3 1736 B11R1.167 CC(=O)c1cc(ccc1C)Cl 1458a_100000692595_200000210301 [0,1,1,0,0,0|1,0,0]=3 1737 B11R1.167 CC(=O)c1cc(ccc1C)F 1458a_100000240043_200000210301 [0,1,1,0,0,0|1,0,0]=3 1738 B11R1.167 CC(=O)c1cc(ccc1C)I 1458a_100000688012_200000210301 [0,1,1,0,0,0|1,0,0]=3 1739 B11R1.167 CC(=O)c1cc(ccc1C)O 1458a_100000687834_200000210301 [0,1,1,0,0,0|1,0,0]=3 1740 B11R1.167 CC(=O)c1cc(ccc1C)O 271570a_203496583355_100012706819 [0,1,1,0,0,0|1,0,0]=3 1741 B11R1.167 CC(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200000210301 [0,1,1,0,0,0|2,0,0]=4 1742 B11R1.167 CC(=O)c1cc(ccc1Cl)C 1458a_100011290873_200000210301 [0,1,1,0,0,0|2,0,0]=4 1743 B11R1.167 CC(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200000210301 [0,1,1,0,0,0|2,0,0]=4 1744 B11R1.167 CC(=O)c1cc(ccc1Cl)F 1458a_100011219680_200000210301 [0,1,1,0,0,0|2,0,0]=4 1745 B11R1.167 CC(=O)c1cc(ccc1Cl)I 1458a_100000688013_200000210301 [0,1,1,0,0,0|2,0,0]=4 1746 B11R1.167 CC(=O)c1cc(ccc1Cl)O 1458a_100000719527_200000210301 [0,1,1,0,0,0|2,0,0]=4 1747 B11R1.167 CC(=O)c1cc(ccc1Cl)O 271570a_203496583355_100010712560 [0,1,1,0,0,0|2,0,0]=4 1748 B11R1.167 CC(=O)c1cc(ccc1F)Br 1458a_100000212322_200000210301 [0,1,1,0,0,0|2,0,0]=4 1749 B11R1.167 CC(=O)c1cc(ccc1F)C 1458a_100000749327_200000210301 [0,1,1,0,0,0|2,0,0]=4 1750 B11R1.167 CC(=O)c1cc(ccc1F)Cl 1458a_100000214954_200000210301 [0,1,1,0,0,0|2,0,0]=4 1751 B11R1.167 CC(=O)c1cc(ccc1F)F 1458a_100000198512_200000210301 [0,1,1,0,0,0|2,0,0]=4 1752 B11R1.167 CC(=O)c1cc(ccc1F)I 1458a_100000688014_200000210301 [0,1,1,0,0,0|2,0,0]=4 1753 B11R1.167 CC(=O)c1cc(ccc1F)O 1458a_100000037260_200000210301 [0,1,1,0,0,0|2,0,0]=4 1754 B11R1.167 CC(=O)c1cc(ccc1F)O 271570a_203496583355_100000689017 [0,1,1,0,0,0|2,0,0]=4 1755 B11R1.167 CC(=O)c1cc(ccc1I)Br 1458a_100000183945_200000210301 [0,1,1,0,0,0|2,0,0]=4 1756 B11R1.167 CC(=O)c1cc(ccc1I)C 1458a_100000057929_200000210301 [0,1,1,0,0,0|2,0,0]=4 1757 B11R1.167 CC(=O)c1cc(ccc1I)Cl 1458a_100000739379_200000210301 [0,1,1,0,0,0|2,0,0]=4 1758 B11R1.167 CC(=O)c1cc(ccc1I)F 1458a_100000748905_200000210301 [0,1,1,0,0,0|2,0,0]=4 1759 B11R1.167 CC(=O)c1cc(ccc1I)I 1458a_100000750460_200000210301 [0,1,1,0,0,0|2,0,0]=4 1760 B11R1.167 CC(=O)c1cc(ccc1I)O 1458a_200009995701_200000210301 [0,1,1,0,0,0|2,0,0]=4 1761 B11R1.167 CC(=O)c1cc(ccc1N)O 271570a_203496583355_100000695420 [0,1,1,0,0,0|2,0,0]=4 1762 B11R1.167 CC(=O)c1cc(ccc1O)Br 1458a_100000212140_200000210301 [0,1,1,0,0,0|2,0,0]=4 1763 B11R1.167 CC(=O)c1cc(ccc1O)Br 271570a_203496583355_100012349576 [0,1,1,0,0,0|2,0,0]=4 1764 B11R1.167 CC(=O)c1cc(ccc1O)C 1458a_100000229998_200000210301 [0,1,1,0,0,0|2,0,0]=4 1765 B11R1.167 CC(=O)c1cc(ccc1O)C 271570a_203496583355_100012361225 [0,1,1,0,0,0|2,0,0]=4 1766 B11R1.167 CC(=O)c1cc(ccc1O)Cl 1458a_100000212143_200000210301 [0,1,1,0,0,0|2,0,0]=4 1767 B11R1.167 CC(=O)c1cc(ccc1O)F 1458a_100000742286_200000210301 [0,1,1,0,0,0|2,0,0]=4 1768 B11R1.167 CC(=O)c1cc(ccc1O)F 271570a_203496583355_100012353695 [0,1,1,0,0,0|2,0,0]=4 1769 B11R1.167 CC(=O)c1cc(ccc1O)I 1458a_100000212111_200000210301 [0,1,1,0,0,0|2,0,0]=4 1770 B11R1.167 CC(=O)c1cc(ccc1O)N 271570a_203496583355_100012349454 [0,1,1,0,0,0|2,0,0]=4 1771 B11R1.167 CC(=O)c1cc(ccc1O)O 1458a_100000758025_200000210301 [0,1,1,0,0,0|2,0,0]=4 1772 B11R1.167 CC(=O)c1cc(ccc1O)O 271570a_203496583355_100000212127 [0,1,1,0,0,0|2,0,0]=4 1773 B11R1.167 CC(=O)c1cc(cnc1C)O 271570a_203496583355_100138557192 [0,1,1,0,0,0|2,0,0]=4 1774 B11R1.167 Cc1ccc(c(c1)C(=O)N)O 271570a_203496583355_200012349609 [0,1,1,0,0,0|2,0,0]=4 1775 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Br 1458a_100000689033_200025704644 [0,1,1,0,0,0|2,0,0]=4 1776 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])C 1458a_100000195421_200025704644 [0,1,1,0,0,0|1,0,0]=3 1777 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])Cl 1458a_100011290873_200025704644 [0,1,1,0,0,0|2,0,0]=4 1778 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])F 1458a_100000749327_200025704644 [0,1,1,0,0,0|2,0,0]=4 1779 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])I 1458a_100000057929_200025704644 [0,1,1,0,0,0|2,0,0]=4 1780 B11R1.167 Cc1ccc(c(c1)C(=O)[13CH3])O 1458a_100000229998_200025704644 [0,1,1,0,0,0|2,0,0]=4 1781 B11R1.167 Cc1ccc(cc1B(O)O)O 271570a_203496583355_100010223188 [0,1,1,0,0,0|1,0,1]=4 1782 B11R1.167 Cc1ccc(cc1C(=O)N)O 271570a_203496583355_100012257281 [0,1,1,0,0,0|1,0,0]=3 1783 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Br 1458a_100000759961_200025704644 [0,1,1,0,0,0|1,0,0]=3 1784 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])Cl 1458a_100000692595_200025704644 [0,1,1,0,0,0|1,0,0]=3 1785 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])F 1458a_100000240043_200025704644 [0,1,1,0,0,0|1,0,0]=3 1786 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])I 1458a_100000688012_200025704644 [0,1,1,0,0,0|1,0,0]=3 1787 B11R1.167 Cc1ccc(cc1C(=O)[13CH3])O 1458a_100000687834_200025704644 [0,1,1,0,0,0|1,0,0]=3 1788 B11R1.167 NC(=O)c1cc(ccc1F)O 271570a_203496583355_100000162119 [0,1,1,0,0,0|2,0,0]=4 1789 B11R1.167 NC(=O)c1cc(ccc1N)O 271570a_203496583355_100000740421 [0,1,1,0,0,0|2,0,0]=4 1790 B11R1.167 NC(=O)c1cc(ccc1O)Br 271570a_203496583355_200000162314 [0,1,1,0,0,0|2,0,0]=4 1791 B11R1.167 NC(=O)c1cc(ccc1O)F 271570a_203496583355_100000206434 [0,1,1,0,0,0|2,0,0]=4 1792 B11R1.167 NC(=O)c1cc(ccc1O)N 271570a_203496583355_100015186447 [0,1,1,0,0,0|2,0,0]=4 1793 B11R1.167 NC(=O)c1cc(ccc1O)O 271570a_203496583355_100000192807 [0,1,1,0,0,0|2,0,0]=4 1794 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Br 1458a_100000690610_200025704644 [0,1,1,0,0,0|2,0,0]=4 1795 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)Cl 1458a_100000736951_200025704644 [0,1,1,0,0,0|2,0,0]=4 1796 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)F 1458a_100000212315_200025704644 [0,1,1,0,0,0|2,0,0]=4 1797 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)I 1458a_100000698340_200025704644 [0,1,1,0,0,0|2,0,0]=4 1798 B11R1.167 [13CH3]C(=O)c1cc(ccc1Br)O 1458a_100012352043_200025704644 [0,1,1,0,0,0|2,0,0]=4 1799 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Br 1458a_100000211212_200025704644 [0,1,1,0,0,0|2,0,0]=4 1800 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)Cl 1458a_100000210642_200025704644 [0,1,1,0,0,0|2,0,0]=4 1801 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)F 1458a_100011219680_200025704644 [0,1,1,0,0,0|2,0,0]=4 1802 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)I 1458a_100000688013_200025704644 [0,1,1,0,0,0|2,0,0]=4 1803 B11R1.167 [13CH3]C(=O)c1cc(ccc1Cl)O 1458a_100000719527_200025704644 [0,1,1,0,0,0|2,0,0]=4 1804 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Br 1458a_100000212322_200025704644 [0,1,1,0,0,0|2,0,0]=4 1805 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)Cl 1458a_100000214954_200025704644 [0,1,1,0,0,0|2,0,0]=4 1806 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)F 1458a_100000198512_200025704644 [0,1,1,0,0,0|2,0,0]=4 1807 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)I 1458a_100000688014_200025704644 [0,1,1,0,0,0|2,0,0]=4 1808 B11R1.167 [13CH3]C(=O)c1cc(ccc1F)O 1458a_100000037260_200025704644 [0,1,1,0,0,0|2,0,0]=4 1809 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Br 1458a_100000183945_200025704644 [0,1,1,0,0,0|2,0,0]=4 1810 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)Cl 1458a_100000739379_200025704644 [0,1,1,0,0,0|2,0,0]=4 1811 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)F 1458a_100000748905_200025704644 [0,1,1,0,0,0|2,0,0]=4 1812 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)I 1458a_100000750460_200025704644 [0,1,1,0,0,0|2,0,0]=4 1813 B11R1.167 [13CH3]C(=O)c1cc(ccc1I)O 1458a_200009995701_200025704644 [0,1,1,0,0,0|2,0,0]=4 1814 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Br 1458a_100000212140_200025704644 [0,1,1,0,0,0|2,0,0]=4 1815 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)Cl 1458a_100000212143_200025704644 [0,1,1,0,0,0|2,0,0]=4 1816 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)F 1458a_100000742286_200025704644 [0,1,1,0,0,0|2,0,0]=4 1817 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)I 1458a_100000212111_200025704644 [0,1,1,0,0,0|2,0,0]=4 1818 B11R1.167 [13CH3]C(=O)c1cc(ccc1O)O 1458a_100000758025_200025704644 [0,1,1,0,0,0|2,0,0]=4 1819 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [1,1,0,0,0,0|1,0,1]=4 1820 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [1,1,0,0,0,0|1,0,1]=4 1821 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [1,1,0,0,0,0|1,0,1]=4 1822 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [1,1,0,0,0,0|2,0,0]=4 1823 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [1,1,0,0,0,0|2,0,0]=4 1824 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [1,1,0,0,0,0|2,0,0]=4 1825 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [1,1,0,0,0,0|1,0,1]=4 1826 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [1,1,0,0,0,0|1,0,1]=4 1827 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [1,1,0,0,0,0|1,0,1]=4 1828 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,1,0,0,0,0|2,0,0]=4 1829 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,1,0,0,0,0|2,0,0]=4 1830 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,1,0,0,0,0|1,0,0]=3 1831 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,1,0,0,0,0|1,0,0]=3 1832 B11R2.36 Oc1ccc2c(c1)CCC2 271570a_203496583355_100000745594 [1,1,0,0,0,0|1,0,1]=4 1833 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,1,0,0,0,0|2,0,0]=4 1834 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,1,0,0,0,0|2,0,0]=4 1835 B11R2.36 Oc1ccc2c(c1)CNC2 271570a_203496583355_100000702344 [1,1,0,0,0,0|1,0,1]=4 1836 B11R2.36 Oc1ccc2c(c1)COC2 271570a_203496583355_100000698232 [1,1,0,0,0,0|0,0,1]=3 1837 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,1,0,0,0,0|2,0,0]=4 1838 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,1,0,0,0,0|2,0,0]=4 1839 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,1,0,0,0,0|2,0,0]=4 1840 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,1,0,0,0,0|2,0,0]=4 1841 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,1,0,0,0,0|2,0,0]=4 1842 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,1,0,0,0,0|2,0,0]=4 1843 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,1,0,0,0,0|2,0,0]=4 1844 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,1,0,0,0,0|0,1,1]=4 1845 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,1,0,0,0,0|1,1,0]=4 1846 B11R2.36 Oc1ccc2nonc2c1 271570a_203496583355_100009814275 [1,1,0,0,0,0|2,0,0]=4 1847 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,1,0,0,0,0|2,0,0]=4 1848 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,1,0,0,0,0|2,0,0]=4 1849 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,1,0,0,0,0|2,0,0]=4 1850 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,1,0,0,0,0|1,0,0]=3 1851 B11R2.106 Oc1cccc2c1CCC2 271570a_203496583355_100010343934 [1,1,0,0,0,0|1,0,1]=4 1852 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [1,1,0,0,0,0|2,0,0]=4 1853 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,1,0,0,0,0|2,0,0]=4 1854 B11R2.106 Oc1cccc2c1CNC2 271570a_203496583355_100000703859 [1,1,0,0,0,0|1,0,1]=4 1855 B11R2.106 Oc1cccc2c1COC2 271570a_203496583355_100010384907 [1,1,0,0,0,0|0,0,1]=3 1856 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [1,1,0,0,0,0|2,0,0]=4 1857 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,1,0,0,0,0|2,0,0]=4 1858 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,1,0,0,0,0|2,0,0]=4 1859 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,1,0,0,0,0|2,0,0]=4 1860 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,1,0,0,0,0|2,0,0]=4 1861 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,1,0,0,0,0|2,0,0]=4 1862 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,1,0,0,0,0|2,0,0]=4 1863 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [1,1,0,0,0,0|2,0,0]=4 1864 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,1,0,0,0,0|2,0,0]=4 1865 B11R2.106 Oc1cccc2c1non2 271570a_203496583355_100009820244 [1,1,0,0,0,0|2,0,0]=4 1866 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,1,0,0,0,0|2,0,0]=4 1867 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,1,0,0,0,0|2,0,0]=4 1868 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,1,0,0,0,0|2,0,0]=4 1869 B11R2.66 O=C1OCc2c1sc(c2)O 271570a_203496583355_100010986393 [0,1,0,0,1,0|1,0,0]=3 1870 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [0,1,0,0,1,0|1,0,1]=4 1871 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,1,0,0,1,0|0,1,1]=4 1872 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,1,0,0,1,0|0,1,1]=4 1873 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,1,0,0,1,0|0,1,1]=4 1874 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,1,0,0,1,0|0,1,1]=4 1875 B13R2.57 COC1Cc2ccccc2CO1 34a_200000095866_200000210301 [0,1,0,0,0,1|0,0,2]=4 1876 B13R2.57 [13CH3]OC1Cc2ccccc2CO1 34a_200000095866_200025704644 [0,1,0,0,0,1|0,0,2]=4 1877 B13R2.155 O=C1CCc2ccc(cc2C1)O 271570a_203496583355_100010138410 [0,1,0,0,0,1|1,0,0]=3 1878 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,1,0,0,0,1|1,0,0]=3 1879 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,0,0,1|2,0,0]=4 1880 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [0,1,0,0,0,1|2,0,0]=4 1881 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [0,1,0,0,0,1|1,0,0]=3 1882 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,0,0,1|0,0,0]=2 1883 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [0,1,0,0,0,1|1,0,1]=4 1884 B13R2.162 O=C1CCc2cccc(c2C1)O 271570a_203496583355_100010006498 [0,1,0,0,0,1|1,0,0]=3 1885 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,1|1,0,1]=4 1886 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,1|1,0,1]=4 1887 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,1,0,0,0,1|1,0,1]=4 1888 B13R2.3683 O=C1CCc2cc(ccc2C1)O 271570a_203496583355_100000753102 [0,1,0,0,0,1|1,0,0]=3 1889 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,1,0,0,0,1|1,0,0]=3 1890 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,1,0,0,0,1|1,0,0]=3 1891 B13R2.3683 O=C1CCc2cc(cnc2N1)O 271570a_203496583355_100010162403 [0,1,0,0,0,1|2,0,0]=4 1892 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,1,0,0,0,1|2,0,0]=4 1893 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,1,0,0,0,1|2,0,0]=4 1894 B13R2.3683 O=C1CSc2cc(ccc2N1)O 271570a_203496583355_100011830382 [0,1,0,0,0,1|2,0,0]=4 1895 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,1,0,0,0,1|1,0,0]=3 1896 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,1,0,0,0,1|1,0,0]=3 1897 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,1,0,0,0,1|0,0,0]=2 1898 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,1,0,0,0,1|1,0,1]=4 1899 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,1,0,0,0,1|1,0,1]=4 1900 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,1,0,0,0,1|2,0,0]=4 1901 B13R2.5179 O=C1CCc2c(cccc2C1)O 271570a_203496583355_100010138409 [0,1,0,0,0,1|1,0,0]=3 1902 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,0,0,1|1,0,0]=3 1903 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,0,0,1|1,0,0]=3 1904 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,1|2,0,0]=4 1905 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,1|1,0,1]=4 1906 B13R2.342 O=C1CCCc2c1cccc2O 271570a_203496583355_100000691372 [0,1,0,0,0,1|1,0,0]=3 1907 B13R2.342 O=C1CCCc2c1cncc2O 271570a_203496583355_100010870523 [0,1,0,0,0,1|2,0,0]=4 1908 B13R2.342 O=C1CCNc2c1cccc2O 271570a_203496583355_115082355814 [0,1,0,0,0,1|1,0,0]=3 1909 B13R2.342 O=C1CCOc2c1cccc2O 271570a_203496583355_100000744318 [0,1,0,0,0,1|1,0,0]=3 1910 B13R2.342 O=C1CCSc2c1cccc2O 271570a_203496583355_100011271337 [0,1,0,0,0,1|1,0,0]=3 1911 B13R2.342 O=C1NCCc2c1cccc2O 271570a_203496583355_100000695023 [0,1,0,0,0,1|1,0,0]=3 1912 B13R2.342 O=c1[nH]ccc2c1cccc2O 271570a_203496583355_100000703947 [0,1,0,0,0,1|1,0,1]=4 1913 B13R2.342 O=c1cc[nH]c2c1cccc2O 271570a_203496583355_100000749886 [0,1,0,0,0,1|1,0,1]=4 1914 B13R2.371 O=c1[nH]nc(c2c1cccc2)O 271570a_203496583355_100010235092 [0,1,0,0,0,1|1,0,1]=4 1915 B13R2.1613 CNC1COCc2c1cccc2 269862a_106832991636_100000117393 [0,1,0,0,0,1|1,0,1]=4 1916 B13R2.1613 COC1COCc2c1cccc2 34a_100012179175_200000210301 [0,1,0,0,0,1|0,0,2]=4 1917 B13R2.1613 [13CH3]OC1COCc2c1cccc2 34a_100012179175_200025704644 [0,1,0,0,0,1|0,0,2]=4 1918 B13R2.4818 O=C1CCCc2c1c(ccc2)O 271570a_203496583355_100009816782 [0,1,0,0,0,1|1,0,0]=3 1919 B13R2.4818 O=C1CCOc2c1c(ccc2)O 271570a_203496583355_100010205896 [0,1,0,0,0,1|1,0,0]=3 1920 B13R2.4818 O=c1[nH]cnc2c1c(ccc2)O 271570a_203496583355_100000696754 [0,1,0,0,0,1|1,0,1]=4 1921 B13R2.9 O=Cc1n[nH]c2c1cccc2O 271570a_203496583355_100009814788 [0,2,0,0,0,0|2,0,0]=4 1922 B13R2.72 CC(=O)C1=CCc2c1cccc2 1458a_100000037392_200000210301 [0,2,0,0,0,0|1,0,0]=3 1923 B13R2.72 CC(=O)C1CCc2c1cccc2 1458a_100000750891_200000210301 [0,2,0,0,0,0|1,0,1]=4 1924 B13R2.72 [13CH3]C(=O)C1=CCc2c1cccc2 1458a_100000037392_200025704644 [0,2,0,0,0,0|1,0,0]=3 1925 B13R2.72 [13CH3]C(=O)C1CCc2c1cccc2 1458a_100000750891_200025704644 [0,2,0,0,0,0|1,0,1]=4 1926 B13R2.662 O=Cc1n[nH]c2c1ccc(c2)O 271570a_203496583355_100009817233 [0,2,0,0,0,0|2,0,0]=4 1927 B13R2.2091 O=Cc1c[nH]c2c1c(ccc2)O 271570a_203496583355_100000693042 [0,2,0,0,0,0|2,0,0]=4 1928 B13R2.2136 O=Cc1c[nH]c2c1cc(cc2)O 271570a_203496583355_100000187850 [0,2,0,0,0,0|2,0,0]=4 1929 B13R2.2136 O=Cc1csc2c1cc(cc2)O 271570a_203496583355_100009814807 [0,2,0,0,0,0|2,0,0]=4 1930 B13R2.2136 O=Cc1n[nH]c2c1cc(cc2)O 271570a_203496583355_100009888965 [0,2,0,0,0,0|2,0,0]=4 1931 B13R2.2931 CNC1CC(=O)c2c1cccc2 2230a_106832991635_100010208147 [0,2,0,0,0,0|1,0,0]=3 1932 B13R2.2931 CNC1CC(=O)c2c1cccc2 7a_106832991635_100010208147 [0,2,0,0,0,0|1,0,0]=3 1933 B13R2.2931 CNC1OC(=O)c2c1cccc2 2230a_106832991635_100009813457 [0,2,0,0,0,0|0,0,0]=2 1934 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_100010208147_200000210301 [0,2,0,0,0,0|1,0,0]=3 1935 B13R2.2931 CSC1CC(=O)c2c1cccc2 62a_200000210301_100010208147 [0,2,0,0,0,0|1,0,0]=3 1936 B13R2.2931 CSC1OC(=O)c2c1cccc2 62a_200000210301_100009813457 [0,2,0,0,0,0|0,0,0]=2 1937 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_100010208147_200025704644 [0,2,0,0,0,0|1,0,0]=3 1938 B13R2.2931 [13CH3]SC1CC(=O)c2c1cccc2 62a_200025704644_100010208147 [0,2,0,0,0,0|1,0,0]=3 1939 B13R2.2931 [13CH3]SC1OC(=O)c2c1cccc2 62a_200025704644_100009813457 [0,2,0,0,0,0|0,0,0]=2 1940 B13R2.45 CSC1Cc2ccccc2C1=O 62a_100011218503_200000210301 [0,2,0,0,0,0|1,0,0]=3 1941 B13R2.45 CSC1Cc2ccccc2C1=O 62a_200000210301_100011218503 [0,2,0,0,0,0|1,0,0]=3 1942 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_100011218503_200025704644 [0,2,0,0,0,0|1,0,0]=3 1943 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_200025704644_100011218503 [0,2,0,0,0,0|1,0,0]=3 1944 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [0,2,0,0,0,0|1,0,0]=3 1945 B13R2.3028 CN1Cc2ccc(cc2C1=O)O 271570a_203496583355_100010125600 [0,2,0,0,0,0|1,0,0]=3 1946 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [0,2,0,0,0,0|2,0,0]=4 1947 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,2,0,0,0,0|1,0,0]=3 1948 B13R2.4825 CN1Cc2c(cccc2C1=O)O 271570a_203496583355_100009817108 [0,2,0,0,0,0|1,0,0]=3 1949 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,2,0,0,0,0|2,0,0]=4 1950 B13R2.4856 O=C1Nc2cccc(c2C1=O)O 271570a_203496583355_100000697038 [0,2,0,0,0,0|2,0,0]=4 1951 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,2,0,0,0,0|1,0,0]=3 1952 B13R2.5190 CN1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010161043 [0,2,0,0,0,0|1,0,0]=3 1953 B13R2.5190 CN1Cc2cc(cnc2C1=O)O 271570a_203496583355_100010258542 [0,2,0,0,0,0|2,0,0]=4 1954 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,2,0,0,0,0|2,0,0]=4 1955 B13R2.669 C=Cc1ccc2[nH][nH]c(=O)c2c1 271570a_100011290941_100012353726 [0,2,0,0,0,0|2,0,0]=4 1956 B13R2.669 C=Cc1ccc2c(c1)C(=O)CC2 271570a_100011290941_100000759401 [0,2,0,0,0,0|1,0,0]=3 1957 B13R2.669 C=Cc1ccc2c(c1)C(=O)CO2 271570a_100011290941_100000752586 [0,2,0,0,0,0|2,0,0]=4 1958 B13R2.669 C=Cc1ccc2c(c1)C(=O)NC2 271570a_100011290941_100010171230 [0,2,0,0,0,0|1,0,0]=3 1959 B13R2.669 C=Cc1ccc2c(c1)C(=O)OC2 271570a_100011290941_100000693025 [0,2,0,0,0,0|0,0,0]=2 1960 B13R2.669 C=Cc1ccc2c(n1)C(=O)CC2 271570a_100011290941_100000701527 [0,2,0,0,0,0|2,0,0]=4 1961 B13R2.669 C=Cc1ccc2o[nH]c(=O)c2c1 271570a_100011290941_100000732257 [0,2,0,0,0,0|2,0,0]=4 1962 B13R2.669 C=Cc1cnc2c(c1)C(=O)CC2 271570a_100011290941_100010174022 [0,2,0,0,0,0|2,0,0]=4 1963 B13R2.669 COc1ccc2c(c1)C(=O)CC2 34a_100009827925_200000210301 [0,2,0,0,0,0|1,0,0]=3 1964 B13R2.669 COc1ccc2c(c1)C(=O)CC2 7a_100009827925_200000210301 [0,2,0,0,0,0|1,0,0]=3 1965 B13R2.669 COc1ccc2c(c1)C(=O)NC2 34a_100000087830_200000210301 [0,2,0,0,0,0|1,0,0]=3 1966 B13R2.669 CSc1ccc2[nH][nH]c(=O)c2c1 62a_200000210301_100012353726 [0,2,0,0,0,0|2,0,0]=4 1967 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_100000759401_200000210301 [0,2,0,0,0,0|1,0,0]=3 1968 B13R2.669 CSc1ccc2c(c1)C(=O)CC2 62a_200000210301_100000759401 [0,2,0,0,0,0|1,0,0]=3 1969 B13R2.669 CSc1ccc2c(c1)C(=O)CO2 62a_200000210301_100000752586 [0,2,0,0,0,0|2,0,0]=4 1970 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_100000688121_200000210301 [0,2,0,0,0,0|1,0,0]=3 1971 B13R2.669 CSc1ccc2c(c1)C(=O)NC2 62a_200000210301_100000688121 [0,2,0,0,0,0|1,0,0]=3 1972 B13R2.669 CSc1ccc2c(c1)C(=O)OC2 62a_100000693025_200000210301 [0,2,0,0,0,0|0,0,0]=2 1973 B13R2.669 CSc1ccc2c(n1)C(=O)CC2 62a_100000701527_200000210301 [0,2,0,0,0,0|2,0,0]=4 1974 B13R2.669 CSc1ccc2c(n1)C(=O)CC2 62a_200000210301_100000701527 [0,2,0,0,0,0|2,0,0]=4 1975 B13R2.669 CSc1ccc2o[nH]c(=O)c2c1 62a_200000210301_100000732257 [0,2,0,0,0,0|2,0,0]=4 1976 B13R2.669 CSc1cnc2c(c1)C(=O)CC2 62a_100010174022_200000210301 [0,2,0,0,0,0|2,0,0]=4 1977 B13R2.669 CSc1cnc2c(c1)C(=O)CC2 62a_200000210301_100010174022 [0,2,0,0,0,0|2,0,0]=4 1978 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 34a_100009827925_200025704644 [0,2,0,0,0,0|1,0,0]=3 1979 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)CC2 7a_100009827925_200025704644 [0,2,0,0,0,0|1,0,0]=3 1980 B13R2.669 [13CH3]Oc1ccc2c(c1)C(=O)NC2 34a_100000087830_200025704644 [0,2,0,0,0,0|1,0,0]=3 1981 B13R2.669 [13CH3]Sc1ccc2[nH][nH]c(=O)c2c1 62a_200025704644_100012353726 [0,2,0,0,0,0|2,0,0]=4 1982 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_100000759401_200025704644 [0,2,0,0,0,0|1,0,0]=3 1983 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CC2 62a_200025704644_100000759401 [0,2,0,0,0,0|1,0,0]=3 1984 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)CO2 62a_200025704644_100000752586 [0,2,0,0,0,0|2,0,0]=4 1985 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_100000688121_200025704644 [0,2,0,0,0,0|1,0,0]=3 1986 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)NC2 62a_200025704644_100000688121 [0,2,0,0,0,0|1,0,0]=3 1987 B13R2.669 [13CH3]Sc1ccc2c(c1)C(=O)OC2 62a_100000693025_200025704644 [0,2,0,0,0,0|0,0,0]=2 1988 B13R2.669 [13CH3]Sc1ccc2c(n1)C(=O)CC2 62a_100000701527_200025704644 [0,2,0,0,0,0|2,0,0]=4 1989 B13R2.669 [13CH3]Sc1ccc2c(n1)C(=O)CC2 62a_200025704644_100000701527 [0,2,0,0,0,0|2,0,0]=4 1990 B13R2.669 [13CH3]Sc1ccc2o[nH]c(=O)c2c1 62a_200025704644_100000732257 [0,2,0,0,0,0|2,0,0]=4 1991 B13R2.669 [13CH3]Sc1cnc2c(c1)C(=O)CC2 62a_100010174022_200025704644 [0,2,0,0,0,0|2,0,0]=4 1992 B13R2.669 [13CH3]Sc1cnc2c(c1)C(=O)CC2 62a_200025704644_100010174022 [0,2,0,0,0,0|2,0,0]=4 1993 B13R2.3742 Cc1cc(c2c(c1)C(=O)CC2)O 271570a_203496583355_200012347971 [0,2,0,0,0,0|1,0,0]=3 1994 B13R2.3742 Cc1cc(cc2c1CCC2=O)O 271570a_203496583355_200010133532 [0,2,0,0,0,0|1,0,0]=3 1995 B13R2.3742 O=C1CCc2c1cc(cc2F)O 271570a_203496583355_100000751134 [0,2,0,0,0,0|1,0,0]=3 1996 B13R2.3742 O=C1CCc2c1cc(cc2O)F 271570a_203496583355_100012355282 [0,2,0,0,0,0|1,0,0]=3 1997 B13R2.3790 Nc1ccc2c(c1O)C(=O)CC2 271570a_203496583355_100010218033 [0,2,0,0,0,0|1,0,0]=3 1998 B13R2.3790 O=C1CCc2c1c(c(cc2)F)O 271570a_203496583355_200010133456 [0,2,0,0,0,0|1,0,0]=3 1999 B13R2.5187 Cn1[nH]c(=O)c2c1cc(cc2)O 271570a_203496583355_100011014602 [0,2,0,0,0,0|2,0,0]=4 2000 B13R2.5187 O=C1CC(=O)c2c1ccc(c2)O 271570a_203496583355_100009997049 [0,2,0,0,0,0|1,0,1]=4 2001 B13R2.5187 O=C1NC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185758 [0,2,0,0,0,0|1,0,1]=4 2002 B13R2.5187 O=C1OC(=O)c2c1cc(cn2)O 271570a_203496583355_100010218301 [0,2,0,0,0,0|1,0,1]=4 2003 B13R2.5187 O=C1OC(=O)c2c1ccc(c2)O 271570a_203496583355_100000185860 [0,2,0,0,0,0|0,0,1]=3 2004 B13R2.11634 Cc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010133461 [0,2,0,0,0,0|1,0,0]=3 2005 B13R2.11634 Cc1cc2c(cc1O)CCC2=O 271570a_203496583355_100010010902 [0,2,0,0,0,0|1,0,0]=3 2006 B13R2.11634 Nc1cc2c(cc1O)C(=O)CC2 271570a_203496583355_100010080117 [0,2,0,0,0,0|1,0,0]=3 2007 B13R2.11634 O=C1CCc2c1cc(c(c2)F)O 271570a_203496583355_100010010871 [0,2,0,0,0,0|1,0,0]=3 2008 B13R2.11634 O=C1CCc2c1cc(c(c2)O)F 271570a_203496583355_100010010804 [0,2,0,0,0,0|1,0,0]=3 2009 B13R2.573 C=Cc1cccc2c1CCC2=O 271570a_100011290941_100000744605 [0,2,0,0,0,0|1,0,0]=3 2010 B13R2.573 C=Cc1cccc2c1CNC2=O 271570a_100011290941_100000688282 [0,2,0,0,0,0|1,0,0]=3 2011 B13R2.573 C=Cc1cccc2c1COC2=O 271570a_100011290941_100010167076 [0,2,0,0,0,0|0,0,0]=2 2012 B13R2.573 C=Cc1cccc2c1OCC2=O 271570a_100011290941_100011230590 [0,2,0,0,0,0|2,0,0]=4 2013 B13R2.573 C=Cc1cccc2c1[nH][nH]c2=O 271570a_100011290941_100012199144 [0,2,0,0,0,0|2,0,0]=4 2014 B13R2.573 CNc1cccc2c1CNC2=O 2230a_100000087543_200000210301 [0,2,0,0,0,0|1,0,0]=3 2015 B13R2.573 COc1cccc2c1CCC2=O 34a_100000240044_200000210301 [0,2,0,0,0,0|1,0,0]=3 2016 B13R2.573 COc1cccc2c1CCC2=O 7a_100000240044_200000210301 [0,2,0,0,0,0|1,0,0]=3 2017 B13R2.573 COc1cccc2c1CNC2=O 34a_100000098541_200000210301 [0,2,0,0,0,0|1,0,0]=3 2018 B13R2.573 CSc1cccc2c1CCC2=O 62a_100000049675_200000210301 [0,2,0,0,0,0|1,0,0]=3 2019 B13R2.573 CSc1cccc2c1CCC2=O 62a_200000210301_100000049675 [0,2,0,0,0,0|1,0,0]=3 2020 B13R2.573 CSc1cccc2c1CNC2=O 62a_100000688282_200000210301 [0,2,0,0,0,0|1,0,0]=3 2021 B13R2.573 CSc1cccc2c1COC2=O 62a_100010167076_200000210301 [0,2,0,0,0,0|0,0,0]=2 2022 B13R2.573 CSc1cccc2c1OCC2=O 62a_200000210301_100011230590 [0,2,0,0,0,0|2,0,0]=4 2023 B13R2.573 [13CH3]Nc1cccc2c1CNC2=O 2230a_100000087543_200025704644 [0,2,0,0,0,0|1,0,0]=3 2024 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 34a_100000240044_200025704644 [0,2,0,0,0,0|1,0,0]=3 2025 B13R2.573 [13CH3]Oc1cccc2c1CCC2=O 7a_100000240044_200025704644 [0,2,0,0,0,0|1,0,0]=3 2026 B13R2.573 [13CH3]Oc1cccc2c1CNC2=O 34a_100000098541_200025704644 [0,2,0,0,0,0|1,0,0]=3 2027 B13R2.573 [13CH3]Sc1cccc2c1CCC2=O 62a_100000049675_200025704644 [0,2,0,0,0,0|1,0,0]=3 2028 B13R2.573 [13CH3]Sc1cccc2c1CCC2=O 62a_200025704644_100000049675 [0,2,0,0,0,0|1,0,0]=3 2029 B13R2.573 [13CH3]Sc1cccc2c1CNC2=O 62a_100000688282_200025704644 [0,2,0,0,0,0|1,0,0]=3 2030 B13R2.573 [13CH3]Sc1cccc2c1COC2=O 62a_100010167076_200025704644 [0,2,0,0,0,0|0,0,0]=2 2031 B13R2.573 [13CH3]Sc1cccc2c1OCC2=O 62a_200025704644_100011230590 [0,2,0,0,0,0|2,0,0]=4 2032 B13R2.4857 O=C1NC(=O)c2c1cccc2O 271570a_203496583355_100010194295 [0,2,0,0,0,0|1,0,1]=4 2033 B13R2.4857 O=C1OC(=O)c2c1cccc2O 271570a_203496583355_100010195870 [0,2,0,0,0,0|0,0,1]=3 2034 B13R2.5151 Cc1ccc(c2c1C(=O)CC2)O 271570a_203496583355_100010091368 [0,2,0,0,0,0|1,0,0]=3 2035 B13R2.5151 O=C1CCc2c1c(ccc2F)O 271570a_203496583355_100000694073 [0,2,0,0,0,0|1,0,0]=3 2036 B13R2.5151 O=C1CCc2c1c(ccc2O)F 271570a_203496583355_100012347972 [0,2,0,0,0,0|1,0,0]=3 2037 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_100009816527 [0,2,0,0,0,0|1,0,0]=3 2038 B13R2.5151 O=C1CCc2c1c(ccc2O)O 271570a_203496583355_200010133748 [0,2,0,0,0,0|1,0,0]=3 2039 B13R2.5180 Cc1c(ccc2c1CCC2=O)O 271570a_203496583355_100010133460 [0,2,0,0,0,0|1,0,0]=3 2040 B13R2.5180 Cc1c(ccc2c1COC2=O)O 271570a_203496583355_100010986288 [0,2,0,0,0,0|0,0,0]=2 2041 B13R2.5180 Cc1ccc2c(c1O)CCC2=O 271570a_203496583355_100010133459 [0,2,0,0,0,0|1,0,0]=3 2042 B13R2.5180 O=C1CCc2c1ccc(c2F)O 271570a_203496583355_100010133455 [0,2,0,0,0,0|1,0,0]=3 2043 B13R2.5180 O=C1CCc2c1ccc(c2O)F 271570a_203496583355_200010133454 [0,2,0,0,0,0|1,0,0]=3 2044 B13R2.582 C=Cc1cccc2c1C(=O)CC2 271570a_100011290941_100009816781 [0,2,0,0,0,0|1,0,0]=3 2045 B13R2.582 C=Cc1cccc2c1C(=O)CO2 271570a_100011290941_100010205902 [0,2,0,0,0,0|2,0,0]=4 2046 B13R2.582 C=Cc1cccc2c1C(=O)NC2 271570a_100011290941_100000724024 [0,2,0,0,0,0|1,0,0]=3 2047 B13R2.582 C=Cc1cccc2c1C(=O)OC2 271570a_100011290941_100010132333 [0,2,0,0,0,0|0,0,0]=2 2048 B13R2.582 C=Cc1cccc2c1c(=O)[nH][nH]2 271570a_100011290941_100010170957 [0,2,0,0,0,0|2,0,0]=4 2049 B13R2.582 COc1cccc2c1C(=O)CC2 34a_100000066596_200000210301 [0,2,0,0,0,0|1,0,0]=3 2050 B13R2.582 COc1cccc2c1C(=O)CC2 7a_100000066596_200000210301 [0,2,0,0,0,0|1,0,0]=3 2051 B13R2.582 COc1cccc2c1C(=O)CO2 34a_200009856558_200000210301 [0,2,0,0,0,0|2,0,0]=4 2052 B13R2.582 CSc1cccc2c1C(=O)CC2 62a_100009816781_200000210301 [0,2,0,0,0,0|1,0,0]=3 2053 B13R2.582 CSc1cccc2c1C(=O)CC2 62a_200000210301_100009816781 [0,2,0,0,0,0|1,0,0]=3 2054 B13R2.582 CSc1cccc2c1C(=O)CO2 62a_200000210301_100010205902 [0,2,0,0,0,0|2,0,0]=4 2055 B13R2.582 CSc1cccc2c1C(=O)NC2 62a_100000724024_200000210301 [0,2,0,0,0,0|1,0,0]=3 2056 B13R2.582 CSc1cccc2c1C(=O)NC2 62a_200000210301_100000724024 [0,2,0,0,0,0|1,0,0]=3 2057 B13R2.582 CSc1cccc2c1C(=O)OC2 62a_100010132333_200000210301 [0,2,0,0,0,0|0,0,0]=2 2058 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 34a_100000066596_200025704644 [0,2,0,0,0,0|1,0,0]=3 2059 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CC2 7a_100000066596_200025704644 [0,2,0,0,0,0|1,0,0]=3 2060 B13R2.582 [13CH3]Oc1cccc2c1C(=O)CO2 34a_200009856558_200025704644 [0,2,0,0,0,0|2,0,0]=4 2061 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CC2 62a_100009816781_200025704644 [0,2,0,0,0,0|1,0,0]=3 2062 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CC2 62a_200025704644_100009816781 [0,2,0,0,0,0|1,0,0]=3 2063 B13R2.582 [13CH3]Sc1cccc2c1C(=O)CO2 62a_200025704644_100010205902 [0,2,0,0,0,0|2,0,0]=4 2064 B13R2.582 [13CH3]Sc1cccc2c1C(=O)NC2 62a_100000724024_200025704644 [0,2,0,0,0,0|1,0,0]=3 2065 B13R2.582 [13CH3]Sc1cccc2c1C(=O)NC2 62a_200025704644_100000724024 [0,2,0,0,0,0|1,0,0]=3 2066 B13R2.582 [13CH3]Sc1cccc2c1C(=O)OC2 62a_100010132333_200025704644 [0,2,0,0,0,0|0,0,0]=2 2067 B13R2.11642 Cc1cc(cc2c1C(=O)CC2)O 271570a_203496583355_100000721622 [0,2,0,0,0,0|1,0,0]=3 2068 B13R2.11642 Cc1cc(cc2c1C(=O)NC2)O 271570a_203496583355_200010764723 [0,2,0,0,0,0|1,0,0]=3 2069 B13R2.11642 O=C1CCc2c1c(cc(c2)F)O 271570a_203496583355_100010079923 [0,2,0,0,0,0|1,0,0]=3 2070 B13R2.11642 O=C1CCc2c1c(cc(c2)O)F 271570a_203496583355_100010125705 [0,2,0,0,0,0|1,0,0]=3 2071 B13R2.11642 O=C1CCc2c1c(cc(c2)O)O 271570a_203496583355_200010214548 [0,2,0,0,0,0|1,0,0]=3 2072 B13R2.11642 O=C1NCc2c1c(cc(c2)O)F 271570a_203496583355_100010161078 [0,2,0,0,0,0|1,0,0]=3 2073 B13R2.2130 C=Cc1ccc2c(=O)[nH][nH]c2c1 271570a_100011290941_100012353722 [0,2,0,0,0,0|2,0,0]=4 2074 B13R2.2130 C=Cc1ccc2c(c1)C=CC2=O 271570a_100011290941_100010210589 [0,2,0,0,0,0|1,0,1]=4 2075 B13R2.2130 C=Cc1ccc2c(c1)CCC2=O 271570a_100011290941_100000737041 [0,2,0,0,0,0|1,0,0]=3 2076 B13R2.2130 C=Cc1ccc2c(c1)CNC2=O 271570a_100011290941_100000692135 [0,2,0,0,0,0|1,0,0]=3 2077 B13R2.2130 C=Cc1ccc2c(c1)COC2=O 271570a_100011290941_100009816608 [0,2,0,0,0,0|0,0,0]=2 2078 B13R2.2130 C=Cc1ccc2c(c1)OCC2=O 271570a_100011290941_100000686717 [0,2,0,0,0,0|2,0,0]=4 2079 B13R2.2130 C=Cc1ccc2c(n1)CNC2=O 271570a_100011290941_200009864240 [0,2,0,0,0,0|2,0,0]=4 2080 B13R2.2130 CNc1ccc2c(n1)CNC2=O 27a_100102657272_200009864240 [0,2,0,0,0,0|2,0,0]=4 2081 B13R2.2130 COc1ccc2c(c1)CCC2=O 34a_100000708912_200000210301 [0,2,0,0,0,0|1,0,0]=3 2082 B13R2.2130 COc1ccc2c(c1)CCC2=O 7a_100000708912_200000210301 [0,2,0,0,0,0|1,0,0]=3 2083 B13R2.2130 COc1ccc2c(c1)CNC2=O 34a_100000098542_200000210301 [0,2,0,0,0,0|1,0,0]=3 2084 B13R2.2130 COc1ccc2c(c1)COC2=O 7a_100000044543_200000210301 [0,2,0,0,0,0|0,0,0]=2 2085 B13R2.2130 CSc1ccc2c(=O)[nH][nH]c2c1 62a_200000210301_100012353722 [0,2,0,0,0,0|2,0,0]=4 2086 B13R2.2130 CSc1ccc2c(c1)C=CC2=O 62a_100010210589_200000210301 [0,2,0,0,0,0|1,0,1]=4 2087 B13R2.2130 CSc1ccc2c(c1)C=CC2=O 62a_200000210301_100010210589 [0,2,0,0,0,0|1,0,1]=4 2088 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_100000737041_200000210301 [0,2,0,0,0,0|1,0,0]=3 2089 B13R2.2130 CSc1ccc2c(c1)CCC2=O 62a_200000210301_100000737041 [0,2,0,0,0,0|1,0,0]=3 2090 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_100000692135_200000210301 [0,2,0,0,0,0|1,0,0]=3 2091 B13R2.2130 CSc1ccc2c(c1)CNC2=O 62a_200000210301_100000692135 [0,2,0,0,0,0|1,0,0]=3 2092 B13R2.2130 CSc1ccc2c(c1)COC2=O 62a_100009816608_200000210301 [0,2,0,0,0,0|0,0,0]=2 2093 B13R2.2130 CSc1ccc2c(c1)OCC2=O 62a_200000210301_100000686717 [0,2,0,0,0,0|2,0,0]=4 2094 B13R2.2130 CSc1ccc2c(n1)CNC2=O 62a_200000210301_200009864240 [0,2,0,0,0,0|2,0,0]=4 2095 B13R2.2130 CSc1ccc2c(n1)CNC2=O 62a_200009864240_200000210301 [0,2,0,0,0,0|2,0,0]=4 2096 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 34a_100000708912_200025704644 [0,2,0,0,0,0|1,0,0]=3 2097 B13R2.2130 [13CH3]Oc1ccc2c(c1)CCC2=O 7a_100000708912_200025704644 [0,2,0,0,0,0|1,0,0]=3 2098 B13R2.2130 [13CH3]Oc1ccc2c(c1)CNC2=O 34a_100000098542_200025704644 [0,2,0,0,0,0|1,0,0]=3 2099 B13R2.2130 [13CH3]Oc1ccc2c(c1)COC2=O 7a_100000044543_200025704644 [0,2,0,0,0,0|0,0,0]=2 2100 B13R2.2130 [13CH3]Sc1ccc2c(=O)[nH][nH]c2c1 62a_200025704644_100012353722 [0,2,0,0,0,0|2,0,0]=4 2101 B13R2.2130 [13CH3]Sc1ccc2c(c1)C=CC2=O 62a_100010210589_200025704644 [0,2,0,0,0,0|1,0,1]=4 2102 B13R2.2130 [13CH3]Sc1ccc2c(c1)C=CC2=O 62a_200025704644_100010210589 [0,2,0,0,0,0|1,0,1]=4 2103 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_100000737041_200025704644 [0,2,0,0,0,0|1,0,0]=3 2104 B13R2.2130 [13CH3]Sc1ccc2c(c1)CCC2=O 62a_200025704644_100000737041 [0,2,0,0,0,0|1,0,0]=3 2105 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_100000692135_200025704644 [0,2,0,0,0,0|1,0,0]=3 2106 B13R2.2130 [13CH3]Sc1ccc2c(c1)CNC2=O 62a_200025704644_100000692135 [0,2,0,0,0,0|1,0,0]=3 2107 B13R2.2130 [13CH3]Sc1ccc2c(c1)COC2=O 62a_100009816608_200025704644 [0,2,0,0,0,0|0,0,0]=2 2108 B13R2.2130 [13CH3]Sc1ccc2c(c1)OCC2=O 62a_200025704644_100000686717 [0,2,0,0,0,0|2,0,0]=4 2109 B13R2.2130 [13CH3]Sc1ccc2c(n1)CNC2=O 62a_200009864240_200025704644 [0,2,0,0,0,0|2,0,0]=4 2110 B13R2.2130 [13CH3]Sc1ccc2c(n1)CNC2=O 62a_200025704644_200009864240 [0,2,0,0,0,0|2,0,0]=4 2111 B9R0.18 C=CC=CC(=O)CCC=C 1458a_100016291481_100000754431 [0,0,2,0,0,0|1,0,0]=3 2112 B9R0.18 C=CC=CC(=O)NCC=C 1626a_100020586998_100016291481 [0,0,2,0,0,0|1,0,0]=3 2113 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,0,1,0,0,1|2,0,0]=4 2114 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,0,1,0,0,1|2,0,0]=4 2115 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,0,1,0,0,1|2,0,0]=4 2116 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,0,1,0,0,1|1,0,0]=3 2117 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,0,1,0,0,1|1,0,0]=3 2118 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,0,1,0,0,1|2,0,0]=4 2119 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,0,1,0,0,1|2,0,0]=4 2120 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,0,1,0,0,1|2,0,0]=4 2121 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,0,1,0,0,1|2,0,0]=4 2122 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,0,1,0,0,1|2,0,0]=4 2123 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,0,1,0,0,1|2,0,0]=4 2124 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,0,1,0,0,1|2,0,0]=4 2125 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,0,1,0,0,1|2,0,0]=4 2126 B11R1.86 CC(=O)Cc1cccnc1C 1458a_100000070787_100000732876 [0,0,1,0,0,1|2,0,0]=4 2127 B11R1.86 CC(=O)Cc1ccncc1C 1458a_100000070787_100020672808 [0,0,1,0,0,1|2,0,0]=4 2128 B11R1.86 CC(=O)Cc1cnccc1C 1458a_100000070787_100000690890 [0,0,1,0,0,1|2,0,0]=4 2129 B11R1.86 CC(=O)Cc1ncccc1C 1458a_100000070787_100000696600 [0,0,1,0,0,1|2,0,0]=4 2130 B11R1.86 CC(=O)Cc1ncccc1C 1458a_200000722269_200000210301 [0,0,1,0,0,1|2,0,0]=4 2131 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,0,1,0,0,1|2,0,0]=4 2132 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,0,1,0,0,1|2,0,0]=4 2133 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,0,1,0,0,1|1,0,0]=3 2134 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,0,1,0,0,1|1,0,0]=3 2135 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,0,1,0,0,1|1,0,0]=3 2136 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,0,1,0,0,1|1,0,0]=3 2137 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,0,1,0,0,1|2,0,0]=4 2138 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,0,1,0,0,1|2,0,0]=4 2139 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,0,1,0,0,1|2,0,0]=4 2140 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,0,1,0,0,1|2,0,0]=4 2141 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,0,1,0,0,1|2,0,0]=4 2142 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,0,1,0,0,1|2,0,0]=4 2143 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,0,1,0,0,1|2,0,0]=4 2144 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,0,1,0,0,1|2,0,0]=4 2145 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,0,1,0,0,1|2,0,0]=4 2146 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,0,1,0,0,1|2,0,0]=4 2147 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,0,1,0,0,1|2,0,0]=4 2148 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,0,1,0,0,1|2,0,0]=4 2149 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,0,1,0,0,1|2,0,0]=4 2150 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,0,1,0,0,1|2,0,0]=4 2151 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,0,1,0,0,1|1,0,0]=3 2152 B11R1.86 Cc1cccnc1CC(=O)[13CH3] 1458a_200000722269_200025704644 [0,0,1,0,0,1|2,0,0]=4 2153 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,0,1,0,0,1|2,0,0]=4 2154 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,0,1,0,0,1|2,0,0]=4 2155 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,0,1,0,0,1|2,0,0]=4 2156 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,0,1,0,0,1|2,0,0]=4 2157 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,0,1,0,0,1|2,0,0]=4 2158 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,0,1,0,0,1|2,0,0]=4 2159 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,0,1,0,0,1|2,0,0]=4