0 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [0,0,0,0,0,0|2,0,1]=3 1 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [0,0,0,0,0,0|2,0,1]=3 2 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [0,0,0,0,0,0|2,0,1]=3 3 B11R2.10 CN1Cc2cccnc2C1 269982a_100000726175_200000210301 [0,0,0,0,0,0|3,0,1]=4 4 B11R2.10 CN1Cc2ccncc2C1 2230a_100000730608_200000210301 [0,0,0,0,0,0|3,0,1]=4 5 B11R2.10 CN1Cc2ccncc2C1 269982a_100000730608_200000210301 [0,0,0,0,0,0|3,0,1]=4 6 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,0,0,0|2,0,0]=2 7 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,0,0,0|1,0,0]=1 8 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,0,0,0|1,1,0]=2 9 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [0,0,0,0,0,0|3,0,0]=3 10 B11R2.10 Oc1cn2ccccc2n1 271570a_203496583355_100009819586 [0,0,0,0,0,0|3,0,0]=3 11 B11R2.10 Oc1cn2ncccc2n1 271570a_203496583355_200010296001 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [0,0,0,0,0,0|3,0,0]=3 13 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,0,0,0,0,0|2,1,0]=3 14 B11R2.10 Oc1nc2cccnc2s1 271570a_203496583355_100010188088 [0,0,0,0,0,0|3,1,0]=4 15 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [0,0,0,0,0,0|2,0,1]=3 16 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [0,0,0,0,0,0|2,0,1]=3 17 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [0,0,0,0,0,0|2,0,1]=3 18 B11R2.10 [13CH3]N1Cc2cccnc2C1 269982a_100000726175_200025704644 [0,0,0,0,0,0|3,0,1]=4 19 B11R2.10 [13CH3]N1Cc2ccncc2C1 2230a_100000730608_200025704644 [0,0,0,0,0,0|3,0,1]=4 20 B11R2.10 [13CH3]N1Cc2ccncc2C1 269982a_100000730608_200025704644 [0,0,0,0,0,0|3,0,1]=4 21 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,0,0|1,1,0]=3 22 B12R2.18 Cc1nc2ccccn2c1O 271570a_203496583355_100009816614 [0,1,0,0,0,0|2,0,0]=3 23 B12R2.18 Cc1nc2cccnn2c1O 271570a_203496583355_200010336598 [0,1,0,0,0,0|3,0,0]=4 24 B12R2.18 Cc1nn2cccnc2c1O 271570a_203496583355_100010221215 [0,1,0,0,0,0|3,0,0]=4 25 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,0,0|0,0,0]=1 26 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,0,0|0,1,0]=2 27 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [0,1,0,0,0,0|3,0,0]=4 28 B12R2.18 Cn1nc2ccccc2c1O 271570a_203496583355_100010163699 [0,1,0,0,0,0|2,0,0]=3 29 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,1,0,0,0,0|1,0,1]=3 30 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,1,0,0,0,0|0,0,1]=2 31 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,1,0,0,0,0|0,1,1]=3 32 B12R2.32 C=Cc1cc2cccnc2[nH]1 271570a_100011290941_100010079843 [0,1,0,0,0,0|2,0,1]=4 33 B12R2.32 C=Cc1cn2ccccc2n1 271570a_100011290941_100009819586 [0,1,0,0,0,0|2,0,1]=4 34 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,1,0,0,0,0|2,0,1]=4 35 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,1,0,0,0,0|1,1,1]=4 36 B12R2.32 CCN1Cc2ccccc2C1 2230a_100000752595_100000210202 [0,1,0,0,0,0|2,0,1]=4 37 B12R2.32 CCN1Cc2ccccc2C1 269982a_100000752595_100000204670 [0,1,0,0,0,0|2,0,1]=4 38 B12R2.32 CCN1Cc2ccccc2C1 34a_100000752595_100000210202 [0,1,0,0,0,0|2,0,1]=4 39 B12R2.32 CNC1Cc2ccccc2C1 2230a_100000753258_200000210301 [0,1,0,0,0,0|1,0,2]=4 40 B12R2.32 CNC1Cc2ccccc2C1 34a_100000753258_200000210301 [0,1,0,0,0,0|1,0,2]=4 41 B12R2.32 CNC1Cc2ccccc2C1 34a_100102657272_100000753484 [0,1,0,0,0,0|1,0,2]=4 42 B12R2.32 CNC1Cc2ccccc2C1 7a_106832991635_100000753484 [0,1,0,0,0,0|1,0,2]=4 43 B12R2.32 CNc1nc2ccccc2[nH]1 27a_100102657272_100009814255 [0,1,0,0,0,0|2,0,0]=3 44 B12R2.32 CNc1nc2ccccc2s1 27a_100102657272_100000751744 [0,1,0,0,0,0|1,1,0]=3 45 B12R2.32 CNc1nc2cccnc2s1 27a_100102657272_100010188088 [0,1,0,0,0,0|2,1,0]=4 46 B12R2.32 COC1Cc2ccccc2C1 34a_100011215286_200000210301 [0,1,0,0,0,0|1,0,2]=4 47 B12R2.32 COC1Cc2ccccc2C1 34a_100138415774_100000753484 [0,1,0,0,0,0|1,0,2]=4 48 B12R2.32 CSC1Cc2ccccc2C1 62a_200000210301_100000753484 [0,1,0,0,0,0|1,0,2]=4 49 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,1,0,0,0,0|1,0,0]=2 50 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,0,0,0|0,0,0]=1 51 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,1,0,0,0,0|0,1,0]=2 52 B12R2.32 CSc1cc2cccnc2[nH]1 62a_200000210301_100010079843 [0,1,0,0,0,0|2,0,0]=3 53 B12R2.32 CSc1cn2ccccc2n1 62a_200000210301_100009819586 [0,1,0,0,0,0|2,0,0]=3 54 B12R2.32 CSc1cn2ncccc2n1 62a_200000210301_200010296001 [0,1,0,0,0,0|3,0,0]=4 55 B12R2.32 CSc1cn2ncccc2n1 62a_200010296001_200000210301 [0,1,0,0,0,0|3,0,0]=4 56 B12R2.32 CSc1nc2ccccc2[nH]1 62a_200000210301_100009814255 [0,1,0,0,0,0|2,0,0]=3 57 B12R2.32 CSc1nc2ccccc2s1 62a_200000210301_100000751744 [0,1,0,0,0,0|1,1,0]=3 58 B12R2.32 CSc1nc2cccnc2s1 62a_100010188088_200000210301 [0,1,0,0,0,0|2,1,0]=4 59 B12R2.32 CSc1nc2cccnc2s1 62a_200000210301_100010188088 [0,1,0,0,0,0|2,1,0]=4 60 B12R2.32 FCN1Cc2ccccc2C1 269982a_100000752595_100015361967 [0,1,0,0,0,0|2,0,1]=4 61 B12R2.32 FCN1Cc2ccccc2C1 34a_100000752595_100015361967 [0,1,0,0,0,0|2,0,1]=4 62 B12R2.32 [13CH3]NC1Cc2ccccc2C1 2230a_100000753258_200025704644 [0,1,0,0,0,0|1,0,2]=4 63 B12R2.32 [13CH3]NC1Cc2ccccc2C1 34a_100000753258_200025704644 [0,1,0,0,0,0|1,0,2]=4 64 B12R2.32 [13CH3]OC1Cc2ccccc2C1 34a_100011215286_200025704644 [0,1,0,0,0,0|1,0,2]=4 65 B12R2.32 [13CH3]SC1Cc2ccccc2C1 62a_200025704644_100000753484 [0,1,0,0,0,0|1,0,2]=4 66 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,1,0,0,0,0|1,0,0]=2 67 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,0,0,0|0,0,0]=1 68 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,1,0,0,0,0|0,1,0]=2 69 B12R2.32 [13CH3]Sc1cc2cccnc2[nH]1 62a_200025704644_100010079843 [0,1,0,0,0,0|2,0,0]=3 70 B12R2.32 [13CH3]Sc1cn2ccccc2n1 62a_200025704644_100009819586 [0,1,0,0,0,0|2,0,0]=3 71 B12R2.32 [13CH3]Sc1cn2ncccc2n1 62a_200010296001_200025704644 [0,1,0,0,0,0|3,0,0]=4 72 B12R2.32 [13CH3]Sc1cn2ncccc2n1 62a_200025704644_200010296001 [0,1,0,0,0,0|3,0,0]=4 73 B12R2.32 [13CH3]Sc1nc2ccccc2[nH]1 62a_200025704644_100009814255 [0,1,0,0,0,0|2,0,0]=3 74 B12R2.32 [13CH3]Sc1nc2ccccc2s1 62a_200025704644_100000751744 [0,1,0,0,0,0|1,1,0]=3 75 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_100010188088_200025704644 [0,1,0,0,0,0|2,1,0]=4 76 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_200025704644_100010188088 [0,1,0,0,0,0|2,1,0]=4 77 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,0,0|1,0,0]=2 78 B12R2.202 CN1Cc2cccc(c2C1)Br 2230a_100000703859_200000210301 [0,1,0,0,0,0|2,0,1]=4 79 B12R2.202 CN1Cc2cccc(c2C1)Br 269982a_100000703859_200000210301 [0,1,0,0,0,0|2,0,1]=4 80 B12R2.202 CN1Cc2cccc(c2C1)Br 34a_100000703859_200000210301 [0,1,0,0,0,0|2,0,1]=4 81 B12R2.202 CN1Cc2cccc(c2C1)Cl 2230a_100000731892_200000210301 [0,1,0,0,0,0|2,0,1]=4 82 B12R2.202 CN1Cc2cccc(c2C1)Cl 269982a_100000731892_200000210301 [0,1,0,0,0,0|2,0,1]=4 83 B12R2.202 CN1Cc2cccc(c2C1)Cl 34a_100000731892_200000210301 [0,1,0,0,0,0|2,0,1]=4 84 B12R2.202 CN1Cc2cccc(c2C1)F 269982a_100000051403_200000210301 [0,1,0,0,0,0|2,0,1]=4 85 B12R2.202 CN1Cc2cccc(c2C1)F 34a_100000051403_200000210301 [0,1,0,0,0,0|2,0,1]=4 86 B12R2.202 CN1Cc2cccc(c2C1)O 269982a_100015191671_200000210301 [0,1,0,0,0,0|2,0,1]=4 87 B12R2.202 CN1Cc2cccc(c2C1)O 34a_100015191671_200000210301 [0,1,0,0,0,0|2,0,1]=4 88 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,0,0|1,0,0]=2 89 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,0,0,0|2,0,0]=3 90 B12R2.202 Cc1cc2c(ncnc2[nH]1)O 271570a_203496583355_100009847220 [0,1,0,0,0,0|3,0,0]=4 91 B12R2.202 Cc1cc2c(ncnc2s1)O 271570a_203496583355_100000753035 [0,1,0,0,0,0|2,1,0]=4 92 B12R2.202 Cc1cc2ncnc(c2s1)O 271570a_203496583355_200009846640 [0,1,0,0,0,0|2,1,0]=4 93 B12R2.202 Cc1cccc2c1CN(C2)C 2230a_100020635169_200000210301 [0,1,0,0,0,0|2,0,1]=4 94 B12R2.202 Cc1cccc2c1CN(C2)C 269982a_100020635169_200000210301 [0,1,0,0,0,0|2,0,1]=4 95 B12R2.202 Cc1cccc2c1CN(C2)C 34a_100020635169_200000210301 [0,1,0,0,0,0|2,0,1]=4 96 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 2230a_100020635169_200025704644 [0,1,0,0,0,0|2,0,1]=4 97 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 269982a_100020635169_200025704644 [0,1,0,0,0,0|2,0,1]=4 98 B12R2.202 Cc1cccc2c1CN(C2)[13CH3] 34a_100020635169_200025704644 [0,1,0,0,0,0|2,0,1]=4 99 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,1,0,0,0,0|2,1,0]=4 100 B12R2.202 Cc1cn2c(cccc2n1)O 271570a_203496583355_100009817088 [0,1,0,0,0,0|2,0,0]=3 101 B12R2.202 Cc1cn2ccnc(c2n1)O 271570a_203496583355_100000098434 [0,1,0,0,0,0|3,0,0]=4 102 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,0,0,0|2,0,0]=3 103 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,0,0,0|1,0,0]=2 104 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,0,0,0|1,1,0]=3 105 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,0,0,0|1,0,0]=2 106 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,0,0,0|1,1,0]=3 107 B12R2.202 Cc1nc2cncc(c2o1)O 271570a_203496583355_100010197357 [0,1,0,0,0,0|2,0,0]=3 108 B12R2.202 Cn1cc2c(cccc2n1)O 271570a_203496583355_100009817162 [0,1,0,0,0,0|2,0,0]=3 109 B12R2.202 Cn1cc2c(cncc2n1)O 271570a_203496583355_100135144457 [0,1,0,0,0,0|3,0,0]=4 110 B12R2.202 Cn1cc2cccc(c2n1)O 271570a_203496583355_100009817170 [0,1,0,0,0,0|2,0,0]=3 111 B12R2.202 Cn1cc2ccnc(c2n1)O 271570a_203496583355_100010890759 [0,1,0,0,0,0|3,0,0]=4 112 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,0,0,0|1,1,0]=3 113 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,0,0,0|3,0,0]=4 114 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,1,0,0,0,0|2,1,0]=4 115 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,1,0,0,0,0|2,0,0]=3 116 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,1,0,0,0,0|2,1,0]=4 117 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,0,0,0|2,0,1]=4 118 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,0,0,0|2,0,1]=4 119 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,0,0,0|2,0,1]=4 120 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,1,0,0,0,0|2,0,0]=3 121 B12R2.202 Oc1cc2c(ccnc2[nH]1)Cl 271570a_203496583355_100010234028 [0,1,0,0,0,0|3,0,0]=4 122 B12R2.202 Oc1cc2c(nccc2s1)O 271570a_203496583355_100010116216 [0,1,0,0,0,0|2,1,0]=4 123 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,0,0,0|2,0,0]=3 124 B12R2.202 Oc1cc2nccc(c2s1)Cl 271570a_203496583355_100010192579 [0,1,0,0,0,0|2,1,0]=4 125 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,0,0,0|3,0,0]=4 126 B12R2.202 Oc1nc2c(cccc2s1)F 271570a_203496583355_100010008856 [0,1,0,0,0,0|2,1,0]=4 127 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 2230a_100000703859_200025704644 [0,1,0,0,0,0|2,0,1]=4 128 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 269982a_100000703859_200025704644 [0,1,0,0,0,0|2,0,1]=4 129 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Br 34a_100000703859_200025704644 [0,1,0,0,0,0|2,0,1]=4 130 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 2230a_100000731892_200025704644 [0,1,0,0,0,0|2,0,1]=4 131 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 269982a_100000731892_200025704644 [0,1,0,0,0,0|2,0,1]=4 132 B12R2.202 [13CH3]N1Cc2cccc(c2C1)Cl 34a_100000731892_200025704644 [0,1,0,0,0,0|2,0,1]=4 133 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 269982a_100000051403_200025704644 [0,1,0,0,0,0|2,0,1]=4 134 B12R2.202 [13CH3]N1Cc2cccc(c2C1)F 34a_100000051403_200025704644 [0,1,0,0,0,0|2,0,1]=4 135 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 269982a_100015191671_200025704644 [0,1,0,0,0,0|2,0,1]=4 136 B12R2.202 [13CH3]N1Cc2cccc(c2C1)O 34a_100015191671_200025704644 [0,1,0,0,0,0|2,0,1]=4 137 B12R2.606 CN1Cc2ccc(cc2C1)Br 2230a_100000702344_200000210301 [0,1,0,0,0,0|2,0,1]=4 138 B12R2.606 CN1Cc2ccc(cc2C1)Br 269982a_100000702344_200000210301 [0,1,0,0,0,0|2,0,1]=4 139 B12R2.606 CN1Cc2ccc(cc2C1)Br 34a_100000702344_200000210301 [0,1,0,0,0,0|2,0,1]=4 140 B12R2.606 CN1Cc2ccc(cc2C1)Cl 2230a_100015205306_200000210301 [0,1,0,0,0,0|2,0,1]=4 141 B12R2.606 CN1Cc2ccc(cc2C1)Cl 269982a_100015205306_200000210301 [0,1,0,0,0,0|2,0,1]=4 142 B12R2.606 CN1Cc2ccc(cc2C1)Cl 34a_100015205306_200000210301 [0,1,0,0,0,0|2,0,1]=4 143 B12R2.606 CN1Cc2ccc(cc2C1)F 2230a_100000766377_200000210301 [0,1,0,0,0,0|2,0,1]=4 144 B12R2.606 CN1Cc2ccc(cc2C1)F 269982a_100000766377_200000210301 [0,1,0,0,0,0|2,0,1]=4 145 B12R2.606 CN1Cc2ccc(cc2C1)F 34a_100000766377_200000210301 [0,1,0,0,0,0|2,0,1]=4 146 B12R2.606 CN1Cc2ccc(cc2C1)O 2230a_100015195982_200000210301 [0,1,0,0,0,0|2,0,1]=4 147 B12R2.606 CN1Cc2ccc(cc2C1)O 269982a_100015195982_200000210301 [0,1,0,0,0,0|2,0,1]=4 148 B12R2.606 CN1Cc2ccc(cc2C1)O 34a_100015195982_200000210301 [0,1,0,0,0,0|2,0,1]=4 149 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,0,0,0|1,0,0]=2 150 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,0,0,0|0,1,0]=2 151 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,1,0,0,0,0|2,0,0]=3 152 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,0,0,0|1,0,0]=2 153 B12R2.606 Cc1cc2nc(ccn2n1)O 271570a_203496583355_100009892504 [0,1,0,0,0,0|3,0,0]=4 154 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,1,0,0,0,0|2,0,0]=3 155 B12R2.606 Cc1cc2ncc(cn2n1)O 271570a_203496583355_100000736869 [0,1,0,0,0,0|3,0,0]=4 156 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [0,1,0,0,0,0|2,1,0]=4 157 B12R2.606 Cc1cn2cc(ccc2n1)O 271570a_203496583355_100000194050 [0,1,0,0,0,0|2,0,0]=3 158 B12R2.606 Cc1cn2cc(cnc2n1)O 271570a_203496583355_200012362479 [0,1,0,0,0,0|3,0,0]=4 159 B12R2.606 Cc1cn2cc(ncc2n1)O 271570a_203496583355_100010063712 [0,1,0,0,0,0|3,0,0]=4 160 B12R2.606 Cc1cn2ccc(cc2n1)O 271570a_203496583355_100000724326 [0,1,0,0,0,0|2,0,0]=3 161 B12R2.606 Cc1cn2nc(ccc2n1)O 271570a_203496583355_100000086295 [0,1,0,0,0,0|3,0,0]=4 162 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,1,0,0,0,0|2,0,0]=3 163 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,0,0,0|1,0,0]=2 164 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,1,0,0,0,0|1,1,0]=3 165 B12R2.606 Cc1nc2cc(ccn2n1)O 271570a_203496583355_100010063680 [0,1,0,0,0,0|3,0,0]=4 166 B12R2.606 Cc1nc2cc(cnc2o1)O 271570a_203496583355_100010178690 [0,1,0,0,0,0|2,0,0]=3 167 B12R2.606 Cc1nc2cc(cnc2s1)O 271570a_203496583355_100010178691 [0,1,0,0,0,0|2,1,0]=4 168 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,0,0,0|1,0,0]=2 169 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,1,0,0,0,0|1,1,0]=3 170 B12R2.606 Cc1nc2ccc(cn2n1)O 271570a_203496583355_100009815719 [0,1,0,0,0,0|3,0,0]=4 171 B12R2.606 Cc1nc2ccc(nc2[nH]1)O 271570a_203496583355_100000079090 [0,1,0,0,0,0|3,0,0]=4 172 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [0,1,0,0,0,0|3,0,0]=4 173 B12R2.606 Cc1nc2ncc(cc2o1)O 271570a_203496583355_100010235748 [0,1,0,0,0,0|2,0,0]=3 174 B12R2.606 Cn1cc2cc(ccc2n1)O 271570a_203496583355_100009817163 [0,1,0,0,0,0|2,0,0]=3 175 B12R2.606 Cn1cc2cc(cnc2n1)O 271570a_203496583355_100010114929 [0,1,0,0,0,0|3,0,0]=4 176 B12R2.606 Cn1cc2cc(ncc2n1)O 271570a_203496583355_100020640495 [0,1,0,0,0,0|3,0,0]=4 177 B12R2.606 Cn1cc2ccc(cc2n1)O 271570a_203496583355_100009817169 [0,1,0,0,0,0|2,0,0]=3 178 B12R2.606 Nc1ccc2nc(sc2c1)O 271570a_203496583355_100010253933 [0,1,0,0,0,0|2,1,0]=4 179 B12R2.606 Nc1ccc2sc(nc2c1)O 271570a_203496583355_100010329861 [0,1,0,0,0,0|2,1,0]=4 180 B12R2.606 Nc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000764686 [0,1,0,0,0,0|3,0,0]=4 181 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [0,1,0,0,0,0|2,0,0]=3 182 B12R2.606 Nc1nc2cc(ccc2s1)O 271570a_203496583355_100011934045 [0,1,0,0,0,0|2,1,0]=4 183 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [0,1,0,0,0,0|2,0,0]=3 184 B12R2.606 Nc1nc2ccc(cc2s1)O 271570a_203496583355_100102524914 [0,1,0,0,0,0|2,1,0]=4 185 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,0,0,0|2,0,1]=4 186 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,0,0,0|2,0,1]=4 187 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,0,0,0|2,0,1]=4 188 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,0,0,0|2,0,0]=3 189 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,1,0,0,0,0|2,1,0]=4 190 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,1,0,0,0,0|3,0,0]=4 191 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,1,0,0,0,0|2,0,0]=3 192 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,1,0,0,0,0|2,1,0]=4 193 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [0,1,0,0,0,0|3,0,0]=4 194 B12R2.606 Oc1cc2cc(ccc2[nH]1)Br 271570a_203496583355_100011012855 [0,1,0,0,0,0|2,0,0]=3 195 B12R2.606 Oc1cc2cc(ccc2s1)Br 271570a_203496583355_200010198765 [0,1,0,0,0,0|1,1,0]=3 196 B12R2.606 Oc1ccc2nc(sc2c1)Cl 271570a_203496583355_100010163703 [0,1,0,0,0,0|2,1,0]=4 197 B12R2.606 Oc1ccc2nc(sc2c1)O 271570a_203496583355_100010063415 [0,1,0,0,0,0|2,1,0]=4 198 B12R2.606 Oc1cn2cc(ccc2n1)F 271570a_203496583355_100010231931 [0,1,0,0,0,0|3,0,0]=4 199 B12R2.606 Oc1nc2cc(ccc2s1)F 271570a_203496583355_200010206605 [0,1,0,0,0,0|2,1,0]=4 200 B12R2.606 Oc1nc2ccc(cc2s1)F 271570a_203496583355_100000751617 [0,1,0,0,0,0|2,1,0]=4 201 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 2230a_100000702344_200025704644 [0,1,0,0,0,0|2,0,1]=4 202 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 269982a_100000702344_200025704644 [0,1,0,0,0,0|2,0,1]=4 203 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Br 34a_100000702344_200025704644 [0,1,0,0,0,0|2,0,1]=4 204 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 2230a_100015205306_200025704644 [0,1,0,0,0,0|2,0,1]=4 205 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 269982a_100015205306_200025704644 [0,1,0,0,0,0|2,0,1]=4 206 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)Cl 34a_100015205306_200025704644 [0,1,0,0,0,0|2,0,1]=4 207 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 2230a_100000766377_200025704644 [0,1,0,0,0,0|2,0,1]=4 208 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 269982a_100000766377_200025704644 [0,1,0,0,0,0|2,0,1]=4 209 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)F 34a_100000766377_200025704644 [0,1,0,0,0,0|2,0,1]=4 210 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 2230a_100015195982_200025704644 [0,1,0,0,0,0|2,0,1]=4 211 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 269982a_100015195982_200025704644 [0,1,0,0,0,0|2,0,1]=4 212 B12R2.606 [13CH3]N1Cc2ccc(cc2C1)O 34a_100015195982_200025704644 [0,1,0,0,0,0|2,0,1]=4 213 B10R1.4 C=C=Cc1ccccc1Br 271570a_100015277604_100000695589 [0,0,1,0,0,0|1,0,2]=4 214 B10R1.4 C=C=Cc1ccccc1C 271570a_100015277604_100000210755 [0,0,1,0,0,0|1,0,2]=4 215 B10R1.4 C=C=Cc1ccccc1Cl 271570a_100015277604_100000764095 [0,0,1,0,0,0|1,0,2]=4 216 B10R1.4 C=C=Cc1ccccc1F 271570a_100015277604_100011215700 [0,0,1,0,0,0|1,0,2]=4 217 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [0,0,1,0,0,0|1,0,2]=4 218 B10R1.4 C=C=Cc1ccccc1O 271570a_100015277604_100000739446 [0,0,1,0,0,0|0,0,2]=3 219 B10R1.4 C=C=Cc1ccncc1O 271570a_100015277604_100009817591 [0,0,1,0,0,0|1,0,2]=4 220 B10R1.4 C=C=Cc1ncccc1O 271570a_100015277604_100000034122 [0,0,1,0,0,0|1,0,2]=4 221 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [0,0,1,0,0,0|0,0,2]=3 222 B10R1.4 CC=Cc1c[nH]ccc1=O 271570a_100016259895_100009998708 [0,0,1,0,0,0|1,0,1]=3 223 B10R1.4 CC=Cc1c[nH]ccc1=S 271570a_100016259895_200012280681 [0,0,1,0,0,0|1,1,0]=3 224 B10R1.4 CC=Cc1ccc[nH]c1=O 271570a_100016259895_100000050042 [0,0,1,0,0,0|1,0,1]=3 225 B10R1.4 CC=Cc1cccc[n+]1C 271570a_100016259895_100000212160 [0,0,1,0,0,0|2,0,0]=3 226 B10R1.4 CC=Cc1cccc[n+]1[O-] 271570a_100016259895_200000042595 [0,0,1,0,0,0|1,0,1]=3 227 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [0,0,1,0,0,0|1,0,0]=2 228 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,0,1,0,0,0|1,0,0]=2 229 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [0,0,1,0,0,0|1,0,0]=2 230 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [0,0,1,0,0,0|1,0,0]=2 231 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [0,0,1,0,0,0|1,0,0]=2 232 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [0,0,1,0,0,0|0,0,0]=1 233 B10R1.4 CC=Cc1cccnc1Br 271570a_100016259895_100010202626 [0,0,1,0,0,0|2,0,0]=3 234 B10R1.4 CC=Cc1cccnc1C 271570a_100016259895_100000751574 [0,0,1,0,0,0|2,0,0]=3 235 B10R1.4 CC=Cc1cccnc1Cl 271570a_100016259895_100000036424 [0,0,1,0,0,0|2,0,0]=3 236 B10R1.4 CC=Cc1cccnc1F 271570a_100016259895_100009816115 [0,0,1,0,0,0|2,0,0]=3 237 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,0,1,0,0,0|2,0,0]=3 238 B10R1.4 CC=Cc1ccn[nH]c1=O 271570a_100016259895_100000087129 [0,0,1,0,0,0|2,0,1]=4 239 B10R1.4 CC=Cc1ccncc1Br 271570a_100016259895_100000726257 [0,0,1,0,0,0|2,0,0]=3 240 B10R1.4 CC=Cc1ccncc1C 271570a_100016259895_100015191297 [0,0,1,0,0,0|2,0,0]=3 241 B10R1.4 CC=Cc1ccncc1Cl 271570a_100016259895_100000708259 [0,0,1,0,0,0|2,0,0]=3 242 B10R1.4 CC=Cc1ccncc1F 271570a_100016259895_100000047030 [0,0,1,0,0,0|2,0,0]=3 243 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [0,0,1,0,0,0|2,0,0]=3 244 B10R1.4 CC=Cc1ccncc1O 271570a_100016259895_100009817591 [0,0,1,0,0,0|1,0,0]=2 245 B10R1.4 CC=Cc1cnccc1Br 271570a_100016259895_100010138639 [0,0,1,0,0,0|2,0,0]=3 246 B10R1.4 CC=Cc1cnccc1C 271570a_100016259895_100000761580 [0,0,1,0,0,0|2,0,0]=3 247 B10R1.4 CC=Cc1cnccc1Cl 271570a_100016259895_100009995489 [0,0,1,0,0,0|2,0,0]=3 248 B10R1.4 CC=Cc1cnccc1F 271570a_100016259895_100009820683 [0,0,1,0,0,0|2,0,0]=3 249 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [0,0,1,0,0,0|2,0,0]=3 250 B10R1.4 CC=Cc1cncnc1Br 271570a_100016259895_200012461658 [0,0,1,0,0,0|3,0,0]=4 251 B10R1.4 CC=Cc1cncnc1C 271570a_100016259895_100009819671 [0,0,1,0,0,0|3,0,0]=4 252 B10R1.4 CC=Cc1cncnc1Cl 271570a_100016259895_100000758962 [0,0,1,0,0,0|3,0,0]=4 253 B10R1.4 CC=Cc1cncnc1N 271570a_100016259895_100011996079 [0,0,1,0,0,0|3,0,0]=4 254 B10R1.4 CC=Cc1cncnc1O 271570a_100016259895_100000751107 [0,0,1,0,0,0|2,0,0]=3 255 B10R1.4 CC=Cc1cnncc1N 271570a_100016259895_100009829405 [0,0,1,0,0,0|3,0,0]=4 256 B10R1.4 CC=Cc1ncc[nH]c1=O 271570a_100016259895_100000763361 [0,0,1,0,0,0|2,0,1]=4 257 B10R1.4 CC=Cc1ncccc1Br 271570a_100016259895_100000696092 [0,0,1,0,0,0|2,0,0]=3 258 B10R1.4 CC=Cc1ncccc1C 271570a_100016259895_100000751373 [0,0,1,0,0,0|2,0,0]=3 259 B10R1.4 CC=Cc1ncccc1Cl 271570a_100016259895_100011356963 [0,0,1,0,0,0|2,0,0]=3 260 B10R1.4 CC=Cc1ncccc1F 271570a_100016259895_100000685392 [0,0,1,0,0,0|2,0,0]=3 261 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [0,0,1,0,0,0|2,0,0]=3 262 B10R1.4 CC=Cc1ncccc1O 271570a_100016259895_100000034122 [0,0,1,0,0,0|1,0,0]=2 263 B10R1.4 CC=Cc1nccnc1C 271570a_100016259895_100011999405 [0,0,1,0,0,0|3,0,0]=4 264 B10R1.4 CC=Cc1nccnc1F 271570a_100016259895_200010125657 [0,0,1,0,0,0|3,0,0]=4 265 B10R1.4 CC=Cc1nccnc1N 271570a_100016259895_100000747729 [0,0,1,0,0,0|3,0,0]=4 266 B10R1.4 CC=Cc1ncncc1C 271570a_100016259895_100011998708 [0,0,1,0,0,0|3,0,0]=4 267 B10R1.4 CC=Cc1ncncc1F 271570a_100016259895_100000069762 [0,0,1,0,0,0|3,0,0]=4 268 B10R1.4 CC=Cc1ncncc1N 271570a_100016259895_100000709731 [0,0,1,0,0,0|3,0,0]=4 269 B10R1.4 CC=Cc1nnccc1C 271570a_100016259895_100000089043 [0,0,1,0,0,0|3,0,0]=4 270 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [0,0,1,0,0,0|2,0,1]=4 271 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [0,0,1,0,0,0|1,0,2]=4 272 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [0,0,1,0,0,0|2,0,1]=4 273 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [0,0,1,0,0,0|2,0,1]=4 274 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [0,0,1,0,0,0|2,0,1]=4 275 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [0,0,1,0,0,0|1,0,1]=3 276 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [0,0,1,0,0,0|1,0,1]=3 277 B10R1.4 CCOc1cccc[n+]1[O-] 7a_100000211761_100000210202 [0,0,1,0,0,0|2,0,1]=4 278 B10R1.4 CCOc1ccccc1Br 34a_100000181306_100000210202 [0,0,1,0,0,0|1,0,1]=3 279 B10R1.4 CCOc1ccccc1Br 7a_100000181306_100000210202 [0,0,1,0,0,0|1,0,1]=3 280 B10R1.4 CCOc1ccccc1C 34a_100000210338_100000210202 [0,0,1,0,0,0|0,0,2]=3 281 B10R1.4 CCOc1ccccc1C 7a_100000210338_100000210202 [0,0,1,0,0,0|0,0,2]=3 282 B10R1.4 CCOc1ccccc1Cl 34a_100000210172_100000210202 [0,0,1,0,0,0|1,0,1]=3 283 B10R1.4 CCOc1ccccc1Cl 7a_100000210172_100000210202 [0,0,1,0,0,0|1,0,1]=3 284 B10R1.4 CCOc1ccccc1F 34a_100000210171_100000210202 [0,0,1,0,0,0|1,0,1]=3 285 B10R1.4 CCOc1ccccc1F 7a_100000210171_100000210202 [0,0,1,0,0,0|1,0,1]=3 286 B10R1.4 CCOc1ccccc1I 34a_100000739446_100000210202 [0,0,1,0,0,0|1,0,1]=3 287 B10R1.4 CCOc1ccccc1I 7a_100000739446_100000210202 [0,0,1,0,0,0|1,0,1]=3 288 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [0,0,1,0,0,0|1,0,1]=3 289 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [0,0,1,0,0,0|1,0,1]=3 290 B10R1.4 CCOc1ccccc1O 271570a_203496583355_100000230754 [0,0,1,0,0,0|1,0,1]=3 291 B10R1.4 CCOc1cccnc1Br 34a_100000744436_100000210202 [0,0,1,0,0,0|2,0,1]=4 292 B10R1.4 CCOc1cccnc1Br 7a_100000744436_100000210202 [0,0,1,0,0,0|2,0,1]=4 293 B10R1.4 CCOc1cccnc1C 34a_100000745507_100000210202 [0,0,1,0,0,0|1,0,2]=4 294 B10R1.4 CCOc1cccnc1C 7a_100000745507_100000210202 [0,0,1,0,0,0|1,0,2]=4 295 B10R1.4 CCOc1cccnc1Cl 34a_100000757616_100000210202 [0,0,1,0,0,0|2,0,1]=4 296 B10R1.4 CCOc1cccnc1Cl 7a_100000757616_100000210202 [0,0,1,0,0,0|2,0,1]=4 297 B10R1.4 CCOc1cccnc1F 34a_100000061740_100000210202 [0,0,1,0,0,0|2,0,1]=4 298 B10R1.4 CCOc1cccnc1F 7a_100000061740_100000210202 [0,0,1,0,0,0|2,0,1]=4 299 B10R1.4 CCOc1cccnc1I 34a_100000034122_100000210202 [0,0,1,0,0,0|2,0,1]=4 300 B10R1.4 CCOc1cccnc1I 7a_100000034122_100000210202 [0,0,1,0,0,0|2,0,1]=4 301 B10R1.4 CCOc1cccnc1N 34a_100000211975_100000210202 [0,0,1,0,0,0|2,0,1]=4 302 B10R1.4 CCOc1cccnc1N 7a_100000211975_100000210202 [0,0,1,0,0,0|2,0,1]=4 303 B10R1.4 CCOc1cccnc1O 271570a_203496583355_100011597540 [0,0,1,0,0,0|2,0,1]=4 304 B10R1.4 CCOc1cccoc1=O 34a_100000077404_100000210202 [0,0,1,0,0,0|2,0,1]=4 305 B10R1.4 CCOc1cccoc1=O 7a_100000077404_100000210202 [0,0,1,0,0,0|2,0,1]=4 306 B10R1.4 CCOc1ccncc1Br 34a_100011996408_100000210202 [0,0,1,0,0,0|2,0,1]=4 307 B10R1.4 CCOc1ccncc1C 34a_100000694293_100000210202 [0,0,1,0,0,0|1,0,2]=4 308 B10R1.4 CCOc1ccncc1Cl 34a_100011997054_100000210202 [0,0,1,0,0,0|2,0,1]=4 309 B10R1.4 CCOc1ccncc1F 34a_200000081243_100000210202 [0,0,1,0,0,0|2,0,1]=4 310 B10R1.4 CCOc1cnccc1C 34a_100011997053_100000210202 [0,0,1,0,0,0|1,0,2]=4 311 B10R1.4 CCOc1cnccc1C 7a_100011997053_100000210202 [0,0,1,0,0,0|1,0,2]=4 312 B10R1.4 CCOc1cnccc1Cl 34a_100011996695_100000210202 [0,0,1,0,0,0|2,0,1]=4 313 B10R1.4 CCOc1cnccc1I 34a_100000050107_100000210202 [0,0,1,0,0,0|2,0,1]=4 314 B10R1.4 CCOc1cnccc1N 34a_100000753702_100000210202 [0,0,1,0,0,0|2,0,1]=4 315 B10R1.4 CCOc1coccc1=O 34a_100000060831_100000210202 [0,0,1,0,0,0|2,0,1]=4 316 B10R1.4 CCOc1ncccc1Cl 34a_100011290957_100000210202 [0,0,1,0,0,0|2,0,1]=4 317 B10R1.4 CCOc1ncccc1F 34a_100011219419_100000210202 [0,0,1,0,0,0|2,0,1]=4 318 B10R1.4 CCOc1ncccc1N 34a_100000746358_100000210202 [0,0,1,0,0,0|2,0,1]=4 319 B10R1.4 CCOc1ncccc1O 271570a_203496583355_100011465154 [0,0,1,0,0,0|2,0,1]=4 320 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [0,0,1,0,0,0|1,1,1]=4 321 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [0,0,1,0,0,0|1,1,1]=4 322 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [0,0,1,0,0,0|0,1,2]=4 323 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [0,0,1,0,0,0|0,1,2]=4 324 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [0,0,1,0,0,0|1,1,1]=4 325 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [0,0,1,0,0,0|1,1,1]=4 326 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [0,0,1,0,0,0|1,1,1]=4 327 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [0,0,1,0,0,0|1,1,1]=4 328 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [0,0,1,0,0,0|1,1,1]=4 329 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [0,0,1,0,0,0|1,1,1]=4 330 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [0,0,1,0,0,0|1,0,1]=3 331 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [0,0,1,0,0,0|1,0,1]=3 332 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [0,0,1,0,0,0|1,0,1]=3 333 B10R1.4 CCSc1cccnc1O 62a_100000210202_100000760158 [0,0,1,0,0,0|2,0,1]=4 334 B10R1.4 CCSc1cccnc1O 62a_100000760158_100000210202 [0,0,1,0,0,0|2,0,1]=4 335 B10R1.4 CCSc1ccncc1O 62a_100000210202_100009817591 [0,0,1,0,0,0|2,0,1]=4 336 B10R1.4 CCSc1ccncc1O 62a_100009817591_100000210202 [0,0,1,0,0,0|2,0,1]=4 337 B10R1.4 CCSc1ncccc1O 62a_100000034122_100000210202 [0,0,1,0,0,0|2,0,1]=4 338 B10R1.4 CCSc1ncccc1O 62a_100000210202_100000034122 [0,0,1,0,0,0|2,0,1]=4 339 B10R1.4 CNCc1ccccc1Br 207a_100102657272_100000211189 [0,0,1,0,0,0|2,0,1]=4 340 B10R1.4 CNCc1ccccc1Br 2230a_100000689332_200000210301 [0,0,1,0,0,0|2,0,1]=4 341 B10R1.4 CNCc1ccccc1Br 2230a_106832991635_100000184730 [0,0,1,0,0,0|2,0,1]=4 342 B10R1.4 CNCc1ccccc1Br 26a_100102657272_100000181306 [0,0,1,0,0,0|2,0,1]=4 343 B10R1.4 CNCc1ccccc1Br 270004a_106832991635_100000211189 [0,0,1,0,0,0|2,0,1]=4 344 B10R1.4 CNCc1ccccc1Br 34a_100000689332_200000210301 [0,0,1,0,0,0|2,0,1]=4 345 B10R1.4 CNCc1ccccc1Br 34a_100102657272_100000184730 [0,0,1,0,0,0|2,0,1]=4 346 B10R1.4 CNCc1ccccc1Br 7a_106832991635_100000184730 [0,0,1,0,0,0|2,0,1]=4 347 B10R1.4 CNCc1ccccc1C 207a_100102657272_100000211143 [0,0,1,0,0,0|2,0,1]=4 348 B10R1.4 CNCc1ccccc1C 2230a_106832991635_100000211839 [0,0,1,0,0,0|2,0,1]=4 349 B10R1.4 CNCc1ccccc1C 270004a_106832991635_100000211143 [0,0,1,0,0,0|2,0,1]=4 350 B10R1.4 CNCc1ccccc1C 34a_100000174972_200000210301 [0,0,1,0,0,0|2,0,1]=4 351 B10R1.4 CNCc1ccccc1C 34a_100102657272_100000211839 [0,0,1,0,0,0|2,0,1]=4 352 B10R1.4 CNCc1ccccc1C 7a_106832991635_100000211839 [0,0,1,0,0,0|2,0,1]=4 353 B10R1.4 CNCc1ccccc1Cl 207a_100102657272_100000210073 [0,0,1,0,0,0|2,0,1]=4 354 B10R1.4 CNCc1ccccc1Cl 2230a_100000174879_200000210301 [0,0,1,0,0,0|2,0,1]=4 355 B10R1.4 CNCc1ccccc1Cl 2230a_106832991635_100000187162 [0,0,1,0,0,0|2,0,1]=4 356 B10R1.4 CNCc1ccccc1Cl 26a_100102657272_100000210172 [0,0,1,0,0,0|2,0,1]=4 357 B10R1.4 CNCc1ccccc1Cl 270004a_106832991635_100000210073 [0,0,1,0,0,0|2,0,1]=4 358 B10R1.4 CNCc1ccccc1Cl 34a_100000174879_200000210301 [0,0,1,0,0,0|2,0,1]=4 359 B10R1.4 CNCc1ccccc1Cl 34a_100102657272_100000187162 [0,0,1,0,0,0|2,0,1]=4 360 B10R1.4 CNCc1ccccc1Cl 7a_106832991635_100000187162 [0,0,1,0,0,0|2,0,1]=4 361 B10R1.4 CNCc1ccccc1F 207a_100102657272_100000210811 [0,0,1,0,0,0|2,0,1]=4 362 B10R1.4 CNCc1ccccc1F 2230a_106832991635_100000211605 [0,0,1,0,0,0|2,0,1]=4 363 B10R1.4 CNCc1ccccc1F 270004a_106832991635_100000210811 [0,0,1,0,0,0|2,0,1]=4 364 B10R1.4 CNCc1ccccc1F 34a_100000174869_200000210301 [0,0,1,0,0,0|2,0,1]=4 365 B10R1.4 CNCc1ccccc1F 34a_100102657272_100000211605 [0,0,1,0,0,0|2,0,1]=4 366 B10R1.4 CNCc1ccccc1F 7a_106832991635_100000211605 [0,0,1,0,0,0|2,0,1]=4 367 B10R1.4 CNCc1ccccc1I 207a_100102657272_100000010305 [0,0,1,0,0,0|2,0,1]=4 368 B10R1.4 CNCc1ccccc1I 2230a_106832991635_100011215278 [0,0,1,0,0,0|2,0,1]=4 369 B10R1.4 CNCc1ccccc1I 270004a_106832991635_100000010305 [0,0,1,0,0,0|2,0,1]=4 370 B10R1.4 CNCc1ccccc1I 34a_100102657272_100011215278 [0,0,1,0,0,0|2,0,1]=4 371 B10R1.4 CNCc1ccccc1I 7a_106832991635_100011215278 [0,0,1,0,0,0|2,0,1]=4 372 B10R1.4 CNCc1ccccc1O 271570a_203496583355_100000184654 [0,0,1,0,0,0|1,0,1]=3 373 B10R1.4 CNCc1ccccc1O 34a_100000185550_200000210301 [0,0,1,0,0,0|1,0,1]=3 374 B10R1.4 CNCc1cccnc1O 207a_100102657272_100011998315 [0,0,1,0,0,0|2,0,1]=4 375 B10R1.4 CNCc1cccnc1O 270004a_106832991635_100011998315 [0,0,1,0,0,0|2,0,1]=4 376 B10R1.4 CNCc1cccnc1O 271570a_203496583355_103496529121 [0,0,1,0,0,0|2,0,1]=4 377 B10R1.4 CNCc1ncccc1O 34a_100102657272_200020655725 [0,0,1,0,0,0|2,0,1]=4 378 B10R1.4 CNCc1ncccc1O 7a_106832991635_200020655725 [0,0,1,0,0,0|2,0,1]=4 379 B10R1.4 COCc1ccccc1Br 34a_100000756307_200000210301 [0,0,1,0,0,0|2,0,1]=4 380 B10R1.4 COCc1ccccc1Br 34a_100138415774_100000184730 [0,0,1,0,0,0|2,0,1]=4 381 B10R1.4 COCc1ccccc1Br 7a_100000756307_200000210301 [0,0,1,0,0,0|2,0,1]=4 382 B10R1.4 COCc1ccccc1C 34a_100000698903_200000210301 [0,0,1,0,0,0|2,0,1]=4 383 B10R1.4 COCc1ccccc1C 34a_100138415774_100000211839 [0,0,1,0,0,0|2,0,1]=4 384 B10R1.4 COCc1ccccc1C 7a_100000698903_200000210301 [0,0,1,0,0,0|2,0,1]=4 385 B10R1.4 COCc1ccccc1Cl 34a_100000210847_200000210301 [0,0,1,0,0,0|2,0,1]=4 386 B10R1.4 COCc1ccccc1Cl 34a_100138415774_100000187162 [0,0,1,0,0,0|2,0,1]=4 387 B10R1.4 COCc1ccccc1Cl 7a_100000210847_200000210301 [0,0,1,0,0,0|2,0,1]=4 388 B10R1.4 COCc1ccccc1F 34a_100000211962_200000210301 [0,0,1,0,0,0|2,0,1]=4 389 B10R1.4 COCc1ccccc1F 34a_100138415774_100000211605 [0,0,1,0,0,0|2,0,1]=4 390 B10R1.4 COCc1ccccc1F 7a_100000211962_200000210301 [0,0,1,0,0,0|2,0,1]=4 391 B10R1.4 COCc1ccccc1I 34a_100000187465_200000210301 [0,0,1,0,0,0|2,0,1]=4 392 B10R1.4 COCc1ccccc1I 34a_100138415774_100011215278 [0,0,1,0,0,0|2,0,1]=4 393 B10R1.4 COCc1ccccc1I 7a_100000187465_200000210301 [0,0,1,0,0,0|2,0,1]=4 394 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [0,0,1,0,0,0|2,0,1]=4 395 B10R1.4 COCc1ccccc1O 271570a_203496583355_100011493684 [0,0,1,0,0,0|1,0,1]=3 396 B10R1.4 COCc1ncccc1O 34a_100138415774_200020655725 [0,0,1,0,0,0|2,0,1]=4 397 B10R1.4 CSCc1ccccc1Br 62a_100000184730_200000210301 [0,0,1,0,0,0|2,0,1]=4 398 B10R1.4 CSCc1ccccc1Br 62a_200000210301_100000184730 [0,0,1,0,0,0|2,0,1]=4 399 B10R1.4 CSCc1ccccc1C 62a_100000211839_200000210301 [0,0,1,0,0,0|2,0,1]=4 400 B10R1.4 CSCc1ccccc1C 62a_200000210301_100000211839 [0,0,1,0,0,0|2,0,1]=4 401 B10R1.4 CSCc1ccccc1Cl 62a_100000187162_200000210301 [0,0,1,0,0,0|2,0,1]=4 402 B10R1.4 CSCc1ccccc1Cl 62a_200000210301_100000187162 [0,0,1,0,0,0|2,0,1]=4 403 B10R1.4 CSCc1ccccc1F 62a_100000211605_200000210301 [0,0,1,0,0,0|2,0,1]=4 404 B10R1.4 CSCc1ccccc1F 62a_200000210301_100000211605 [0,0,1,0,0,0|2,0,1]=4 405 B10R1.4 CSCc1ccccc1I 62a_100011216222_200000210301 [0,0,1,0,0,0|2,0,1]=4 406 B10R1.4 CSCc1ccccc1I 62a_200000210301_100011216222 [0,0,1,0,0,0|2,0,1]=4 407 B10R1.4 CSCc1ccccc1O 271570a_203496583355_100000148299 [0,0,1,0,0,0|1,0,1]=3 408 B10R1.4 CSCc1ncccc1O 62a_200000210301_200020655725 [0,0,1,0,0,0|2,0,1]=4 409 B10R1.4 CSCc1ncccc1O 62a_200020655725_200000210301 [0,0,1,0,0,0|2,0,1]=4 410 B10R1.4 Cc1ccccc1CN[13CH3] 34a_100000174972_200025704644 [0,0,1,0,0,0|2,0,1]=4 411 B10R1.4 Cc1ccccc1CO[13CH3] 34a_100000698903_200025704644 [0,0,1,0,0,0|2,0,1]=4 412 B10R1.4 Cc1ccccc1CO[13CH3] 7a_100000698903_200025704644 [0,0,1,0,0,0|2,0,1]=4 413 B10R1.4 Cc1ccccc1CS[13CH3] 62a_100000211839_200025704644 [0,0,1,0,0,0|2,0,1]=4 414 B10R1.4 Cc1ccccc1CS[13CH3] 62a_200025704644_100000211839 [0,0,1,0,0,0|2,0,1]=4 415 B10R1.4 Cc1ccccc1OCF 34a_100000210338_100015361967 [0,0,1,0,0,0|1,0,2]=4 416 B10R1.4 Cc1ccccc1OCF 7a_100000210338_100015361967 [0,0,1,0,0,0|1,0,2]=4 417 B10R1.4 FCOc1ccccc1Br 34a_100000181306_100015361967 [0,0,1,0,0,0|2,0,1]=4 418 B10R1.4 FCOc1ccccc1Br 7a_100000181306_100015361967 [0,0,1,0,0,0|2,0,1]=4 419 B10R1.4 FCOc1ccccc1Cl 34a_100000210172_100015361967 [0,0,1,0,0,0|2,0,1]=4 420 B10R1.4 FCOc1ccccc1Cl 7a_100000210172_100015361967 [0,0,1,0,0,0|2,0,1]=4 421 B10R1.4 FCOc1ccccc1F 34a_100000210171_100015361967 [0,0,1,0,0,0|2,0,1]=4 422 B10R1.4 FCOc1ccccc1F 7a_100000210171_100015361967 [0,0,1,0,0,0|2,0,1]=4 423 B10R1.4 FCOc1ccccc1I 34a_100000739446_100015361967 [0,0,1,0,0,0|2,0,1]=4 424 B10R1.4 FCOc1ccccc1I 7a_100000739446_100015361967 [0,0,1,0,0,0|2,0,1]=4 425 B10R1.4 N#CCc1ccccc1O 271570a_203496583355_100000033512 [0,0,1,0,0,0|1,0,2]=4 426 B10R1.4 NCCc1ccccc1O 271570a_203496583355_100000747383 [0,0,1,0,0,0|1,0,2]=4 427 B10R1.4 NNCc1ccccc1O 271570a_203496583355_200016993956 [0,0,1,0,0,0|2,0,1]=4 428 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [0,0,1,0,0,0|2,0,1]=4 429 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [0,0,1,0,0,0|2,0,1]=4 430 B10R1.4 OCCc1ccccc1O 271570a_203496583355_100000731337 [0,0,1,0,0,0|1,0,2]=4 431 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [0,0,1,0,0,0|2,0,1]=4 432 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [0,0,1,0,0,0|2,0,1]=4 433 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [0,0,1,0,0,0|2,0,1]=4 434 B10R1.4 [13CH3]NCc1ccccc1Br 2230a_100000689332_200025704644 [0,0,1,0,0,0|2,0,1]=4 435 B10R1.4 [13CH3]NCc1ccccc1Br 34a_100000689332_200025704644 [0,0,1,0,0,0|2,0,1]=4 436 B10R1.4 [13CH3]NCc1ccccc1Cl 2230a_100000174879_200025704644 [0,0,1,0,0,0|2,0,1]=4 437 B10R1.4 [13CH3]NCc1ccccc1Cl 34a_100000174879_200025704644 [0,0,1,0,0,0|2,0,1]=4 438 B10R1.4 [13CH3]NCc1ccccc1F 34a_100000174869_200025704644 [0,0,1,0,0,0|2,0,1]=4 439 B10R1.4 [13CH3]NCc1ccccc1O 34a_100000185550_200025704644 [0,0,1,0,0,0|1,0,1]=3 440 B10R1.4 [13CH3]OCc1ccccc1Br 34a_100000756307_200025704644 [0,0,1,0,0,0|2,0,1]=4 441 B10R1.4 [13CH3]OCc1ccccc1Br 7a_100000756307_200025704644 [0,0,1,0,0,0|2,0,1]=4 442 B10R1.4 [13CH3]OCc1ccccc1Cl 34a_100000210847_200025704644 [0,0,1,0,0,0|2,0,1]=4 443 B10R1.4 [13CH3]OCc1ccccc1Cl 7a_100000210847_200025704644 [0,0,1,0,0,0|2,0,1]=4 444 B10R1.4 [13CH3]OCc1ccccc1F 34a_100000211962_200025704644 [0,0,1,0,0,0|2,0,1]=4 445 B10R1.4 [13CH3]OCc1ccccc1F 7a_100000211962_200025704644 [0,0,1,0,0,0|2,0,1]=4 446 B10R1.4 [13CH3]OCc1ccccc1I 34a_100000187465_200025704644 [0,0,1,0,0,0|2,0,1]=4 447 B10R1.4 [13CH3]OCc1ccccc1I 7a_100000187465_200025704644 [0,0,1,0,0,0|2,0,1]=4 448 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [0,0,1,0,0,0|2,0,1]=4 449 B10R1.4 [13CH3]SCc1ccccc1Br 62a_100000184730_200025704644 [0,0,1,0,0,0|2,0,1]=4 450 B10R1.4 [13CH3]SCc1ccccc1Br 62a_200025704644_100000184730 [0,0,1,0,0,0|2,0,1]=4 451 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_100000187162_200025704644 [0,0,1,0,0,0|2,0,1]=4 452 B10R1.4 [13CH3]SCc1ccccc1Cl 62a_200025704644_100000187162 [0,0,1,0,0,0|2,0,1]=4 453 B10R1.4 [13CH3]SCc1ccccc1F 62a_100000211605_200025704644 [0,0,1,0,0,0|2,0,1]=4 454 B10R1.4 [13CH3]SCc1ccccc1F 62a_200025704644_100000211605 [0,0,1,0,0,0|2,0,1]=4 455 B10R1.4 [13CH3]SCc1ccccc1I 62a_100011216222_200025704644 [0,0,1,0,0,0|2,0,1]=4 456 B10R1.4 [13CH3]SCc1ccccc1I 62a_200025704644_100011216222 [0,0,1,0,0,0|2,0,1]=4 457 B10R1.4 [13CH3]SCc1ncccc1O 62a_200020655725_200025704644 [0,0,1,0,0,0|2,0,1]=4 458 B10R1.4 [13CH3]SCc1ncccc1O 62a_200025704644_200020655725 [0,0,1,0,0,0|2,0,1]=4 459 B10R1.4 [N-]=[N+]=Nc1ccccc1O 271570a_203496583355_100000762926 [0,0,1,0,0,0|3,0,0]=4 460 B10R1.16 C=CCSc1cc(on1)C 62a_100000210623_100000716708 [0,0,1,0,0,0|2,0,1]=4 461 B10R1.16 C=CCSc1cc(on1)C 62a_100000716708_100000210623 [0,0,1,0,0,0|2,0,1]=4 462 B10R1.16 C=CCSc1ccc(s1)C 62a_100000031368_100000210623 [0,0,1,0,0,0|1,1,1]=4 463 B10R1.16 C=CCSc1ccc(s1)C 62a_100000210623_100000031368 [0,0,1,0,0,0|1,1,1]=4 464 B10R1.16 C=CCSc1csc(c1)C 62a_100000210623_100000759034 [0,0,1,0,0,0|1,1,1]=4 465 B10R1.16 C=CCSc1csc(c1)C 62a_100000759034_100000210623 [0,0,1,0,0,0|1,1,1]=4 466 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [0,0,1,0,0,0|1,0,0]=2 467 B10R1.18 CC(=Cc1ccccn1)C 271570a_100102525489_100011216584 [0,0,1,0,0,0|2,0,0]=3 468 B10R1.18 CC(=Cc1cccnc1)C 271570a_100102525489_100000752921 [0,0,1,0,0,0|2,0,0]=3 469 B10R1.18 CC(=Cc1cccnn1)C 271570a_100102525489_100016991348 [0,0,1,0,0,0|3,0,0]=4 470 B10R1.18 CC(=Cc1ccncc1)C 271570a_100102525489_100000035832 [0,0,1,0,0,0|2,0,0]=3 471 B10R1.18 CC(=Cc1ccncn1)C 271570a_100102525489_100000703185 [0,0,1,0,0,0|3,0,0]=4 472 B10R1.18 CC(=Cc1ccnnc1)C 271570a_100102525489_100000732662 [0,0,1,0,0,0|3,0,0]=4 473 B10R1.18 CC(=Cc1cnccn1)C 271570a_100102525489_100000758340 [0,0,1,0,0,0|3,0,0]=4 474 B10R1.18 CC(=Cc1cncnc1)C 271570a_100102525489_100011206942 [0,0,1,0,0,0|3,0,0]=4 475 B10R1.18 CC(=Cc1ncccn1)C 271570a_100102525489_100000211032 [0,0,1,0,0,0|3,0,0]=4 476 B10R1.18 CC(=O)C[n+]1ccccc1 1458a_200000086051_200000210301 [0,0,1,0,0,0|1,0,2]=4 477 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [0,0,1,0,0,0|0,0,2]=3 478 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000070787_100000721315 [0,0,1,0,0,0|1,0,2]=4 479 B10R1.18 CC(=O)Cc1ccccn1 1458a_100000233486_200000210301 [0,0,1,0,0,0|1,0,2]=4 480 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000070787_100000733263 [0,0,1,0,0,0|1,0,2]=4 481 B10R1.18 CC(=O)Cc1cccnc1 1458a_100000737805_200000210301 [0,0,1,0,0,0|1,0,2]=4 482 B10R1.18 CC(=O)Cc1ccncc1 1458a_100000070787_100000705612 [0,0,1,0,0,0|1,0,2]=4 483 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [0,0,1,0,0,0|1,0,1]=3 484 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [0,0,1,0,0,0|1,0,1]=3 485 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [0,0,1,0,0,0|1,0,1]=3 486 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [0,0,1,0,0,0|1,0,1]=3 487 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [0,0,1,0,0,0|1,0,2]=4 488 B10R1.18 CC(C)Oc1ccccc1 34a_100000210340_100000210206 [0,0,1,0,0,0|0,0,2]=3 489 B10R1.18 CC(C)Oc1ccccc1 7a_100000210340_100000210206 [0,0,1,0,0,0|0,0,2]=3 490 B10R1.18 CC(C)Oc1cccnc1 34a_100000210849_100000210206 [0,0,1,0,0,0|1,0,2]=4 491 B10R1.18 CC(C)Oc1cccnc1 7a_100000210849_100000210206 [0,0,1,0,0,0|1,0,2]=4 492 B10R1.18 CC(C)Oc1ccncc1 34a_100000212176_100000210206 [0,0,1,0,0,0|1,0,2]=4 493 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [0,0,1,0,0,0|0,1,2]=4 494 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [0,0,1,0,0,0|0,1,2]=4 495 B10R1.18 CN(C)Cc1ccccc1 2230a_100000186898_200000210301 [0,0,1,0,0,0|2,0,1]=4 496 B10R1.18 CN(C)Cc1ccccc1 2230a_100102631434_100015291786 [0,0,1,0,0,0|2,0,1]=4 497 B10R1.18 CN(C)Cc1ccccc1 269982a_100000186898_200000210301 [0,0,1,0,0,0|2,0,1]=4 498 B10R1.18 CN(C)Cc1ccccc1 269982a_100102631434_100000211182 [0,0,1,0,0,0|2,0,1]=4 499 B10R1.18 CN(C)Cc1ccccc1 270004a_100102631434_100015611070 [0,0,1,0,0,0|2,0,1]=4 500 B10R1.18 CN([13CH3])Cc1ccccc1 2230a_100000186898_200025704644 [0,0,1,0,0,0|2,0,1]=4 501 B10R1.18 CN([13CH3])Cc1ccccc1 269982a_100000186898_200025704644 [0,0,1,0,0,0|2,0,1]=4 502 B10R1.18 [13CH3]C(=O)C[n+]1ccccc1 1458a_200000086051_200025704644 [0,0,1,0,0,0|1,0,2]=4 503 B10R1.18 [13CH3]C(=O)Cc1ccccn1 1458a_100000233486_200025704644 [0,0,1,0,0,0|1,0,2]=4 504 B10R1.18 [13CH3]C(=O)Cc1cccnc1 1458a_100000737805_200025704644 [0,0,1,0,0,0|1,0,2]=4 505 B10R1.32 C=Cc1cc(sc1C=O)C 271570a_100011290941_100011361552 [0,0,1,0,0,0|1,1,0]=3 506 B10R1.130 C=C=Cc1cc(sc1C)C 271570a_100015277604_100000688054 [0,0,1,0,0,0|0,1,2]=4 507 B10R1.130 C=C=Cc1sc(cc1C)C 271570a_100015277604_100000689295 [0,0,1,0,0,0|0,1,2]=4 508 B10R1.130 CC=Cc1cc(sc1C)C 271570a_100016259895_100000688054 [0,0,1,0,0,0|0,1,2]=4 509 B10R1.130 CC=Cc1sc(cc1C)C 271570a_100016259895_100000689295 [0,0,1,0,0,0|0,1,2]=4 510 B10R2.2 Oc1cc2sccc2s1 271570a_203496583355_200010191111 [0,0,0,0,1,0|2,1,0]=4 511 B12R2.24 CN1CCc2ccccc2C1 2230a_100000188457_200000210301 [0,0,0,0,0,1|2,0,1]=4 512 B12R2.24 CN1CCc2ccccc2C1 269982a_100000188457_200000210301 [0,0,0,0,0,1|2,0,1]=4 513 B12R2.24 CN1CCc2ccccc2C1 34a_100000188457_200000210301 [0,0,0,0,0,1|2,0,1]=4 514 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,1|2,0,0]=3 515 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,1|2,0,0]=3 516 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,1|2,0,0]=3 517 B12R2.24 Oc1ccc2cccnc2c1 271570a_203496583355_100009816655 [0,0,0,0,0,1|3,0,0]=4 518 B12R2.24 Oc1ccc2cccnc2n1 271570a_203496583355_100009888989 [0,0,0,0,0,1|3,0,0]=4 519 B12R2.24 Oc1ccc2ccncc2c1 271570a_203496583355_100000686496 [0,0,0,0,0,1|3,0,0]=4 520 B12R2.24 Oc1ccc2ccncc2n1 271570a_203496583355_100000020162 [0,0,0,0,0,1|3,0,0]=4 521 B12R2.24 Oc1ccc2cnccc2c1 271570a_203496583355_100009816743 [0,0,0,0,0,1|3,0,0]=4 522 B12R2.24 Oc1ccc2ncccc2c1 271570a_203496583355_100000754243 [0,0,0,0,0,1|3,0,0]=4 523 B12R2.24 Oc1ccc2ncccc2n1 271570a_203496583355_100000073381 [0,0,0,0,0,1|3,0,0]=4 524 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,1|2,0,0]=3 525 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,1|2,0,0]=3 526 B12R2.24 Oc1cnc2cccnc2c1 271570a_203496583355_100010246316 [0,0,0,0,0,1|3,0,0]=4 527 B12R2.24 Oc1cnc2ncccc2n1 271570a_203496583355_100000084304 [0,0,0,0,0,1|3,0,0]=4 528 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,1|2,0,0]=3 529 B12R2.24 [13CH3]N1CCc2ccccc2C1 2230a_100000188457_200025704644 [0,0,0,0,0,1|2,0,1]=4 530 B12R2.24 [13CH3]N1CCc2ccccc2C1 269982a_100000188457_200025704644 [0,0,0,0,0,1|2,0,1]=4 531 B12R2.24 [13CH3]N1CCc2ccccc2C1 34a_100000188457_200025704644 [0,0,0,0,0,1|2,0,1]=4 532 B9R1.8 C=C=Cc1ccccc1 271570a_100015277604_100000210277 [1,0,1,0,0,0|0,0,2]=4 533 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,1,0,0,0|0,0,0]=2 534 B9R1.8 CC=Cc1ccccn1 271570a_100016259895_100011216584 [1,0,1,0,0,0|1,0,0]=3 535 B9R1.8 CC=Cc1cccnc1 271570a_100016259895_100000752921 [1,0,1,0,0,0|1,0,0]=3 536 B9R1.8 CC=Cc1cccnn1 271570a_100016259895_100016991348 [1,0,1,0,0,0|2,0,0]=4 537 B9R1.8 CC=Cc1ccncc1 271570a_100016259895_100000035832 [1,0,1,0,0,0|1,0,0]=3 538 B9R1.8 CC=Cc1ccncn1 271570a_100016259895_100000703185 [1,0,1,0,0,0|2,0,0]=4 539 B9R1.8 CC=Cc1ccnnc1 271570a_100016259895_100000732662 [1,0,1,0,0,0|2,0,0]=4 540 B9R1.8 CC=Cc1cnccn1 271570a_100016259895_100000758340 [1,0,1,0,0,0|2,0,0]=4 541 B9R1.8 CC=Cc1cncnc1 271570a_100016259895_100011206942 [1,0,1,0,0,0|2,0,0]=4 542 B9R1.8 CC=Cc1ncccn1 271570a_100016259895_100000211032 [1,0,1,0,0,0|2,0,0]=4 543 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,1,0,0,0|1,0,1]=4 544 B9R1.8 CCOc1ccccc1 34a_100000210340_100000210202 [1,0,1,0,0,0|0,0,1]=3 545 B9R1.8 CCOc1ccccc1 7a_100000210340_100000210202 [1,0,1,0,0,0|0,0,1]=3 546 B9R1.8 CCOc1cccnc1 34a_100000210849_100000210202 [1,0,1,0,0,0|1,0,1]=4 547 B9R1.8 CCOc1cccnc1 7a_100000210849_100000210202 [1,0,1,0,0,0|1,0,1]=4 548 B9R1.8 CCOc1ccncc1 34a_100000212176_100000210202 [1,0,1,0,0,0|1,0,1]=4 549 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,1,0,0,0|0,1,1]=4 550 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,1,0,0,0|0,1,1]=4 551 B9R1.8 CNCc1ccccc1 207a_100102657272_100015611070 [1,0,1,0,0,0|1,0,1]=4 552 B9R1.8 CNCc1ccccc1 2230a_100015324214_200000210301 [1,0,1,0,0,0|1,0,1]=4 553 B9R1.8 CNCc1ccccc1 2230a_106832991635_100015291786 [1,0,1,0,0,0|1,0,1]=4 554 B9R1.8 CNCc1ccccc1 270004a_106832991635_100015611070 [1,0,1,0,0,0|1,0,1]=4 555 B9R1.8 CNCc1ccccc1 34a_100015324214_200000210301 [1,0,1,0,0,0|1,0,1]=4 556 B9R1.8 CNCc1ccccc1 34a_100102657272_100015291786 [1,0,1,0,0,0|1,0,1]=4 557 B9R1.8 CNCc1ccccc1 7a_106832991635_100000211182 [1,0,1,0,0,0|1,0,1]=4 558 B9R1.8 COCc1ccccc1 34a_100000210790_200000210301 [1,0,1,0,0,0|1,0,1]=4 559 B9R1.8 COCc1ccccc1 34a_100138415774_100015291786 [1,0,1,0,0,0|1,0,1]=4 560 B9R1.8 COCc1ccccc1 7a_100000210790_200000210301 [1,0,1,0,0,0|1,0,1]=4 561 B9R1.8 CSCc1ccccc1 62a_100000211182_200000210301 [1,0,1,0,0,0|1,0,1]=4 562 B9R1.8 CSCc1ccccc1 62a_200000210301_100015291786 [1,0,1,0,0,0|1,0,1]=4 563 B9R1.8 FCOc1ccccc1 34a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 564 B9R1.8 FCOc1ccccc1 7a_100000210340_100015361967 [1,0,1,0,0,0|1,0,1]=4 565 B9R1.8 [13CH3]NCc1ccccc1 2230a_100015324214_200025704644 [1,0,1,0,0,0|1,0,1]=4 566 B9R1.8 [13CH3]NCc1ccccc1 34a_100015324214_200025704644 [1,0,1,0,0,0|1,0,1]=4 567 B9R1.8 [13CH3]OCc1ccccc1 34a_100000210790_200025704644 [1,0,1,0,0,0|1,0,1]=4 568 B9R1.8 [13CH3]OCc1ccccc1 7a_100000210790_200025704644 [1,0,1,0,0,0|1,0,1]=4 569 B9R1.8 [13CH3]SCc1ccccc1 62a_100000211182_200025704644 [1,0,1,0,0,0|1,0,1]=4 570 B9R1.8 [13CH3]SCc1ccccc1 62a_200025704644_100015291786 [1,0,1,0,0,0|1,0,1]=4 571 B9R1.15 C=Cc1c[nH]ccc1=O 271570a_100011290941_100009998708 [1,0,1,0,0,0|1,0,1]=4 572 B9R1.15 C=Cc1c[nH]ccc1=S 271570a_100011290941_200012280681 [1,0,1,0,0,0|1,1,0]=4 573 B9R1.15 C=Cc1ccc[nH]c1=O 271570a_100011290941_100000050042 [1,0,1,0,0,0|1,0,1]=4 574 B9R1.15 C=Cc1cccc[n+]1C 271570a_100011290941_100000212160 [1,0,1,0,0,0|2,0,0]=4 575 B9R1.15 C=Cc1cccc[n+]1[O-] 271570a_100011290941_200000042595 [1,0,1,0,0,0|1,0,1]=4 576 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,1,0,0,0|1,0,0]=3 577 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,1,0,0,0|1,0,0]=3 578 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,1,0,0,0|1,0,0]=3 579 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,1,0,0,0|1,0,0]=3 580 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,1,0,0,0|1,0,0]=3 581 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,1,0,0,0|0,0,0]=2 582 B9R1.15 C=Cc1cccnc1Br 271570a_100011290941_100010202626 [1,0,1,0,0,0|2,0,0]=4 583 B9R1.15 C=Cc1cccnc1C 271570a_100011290941_100000751574 [1,0,1,0,0,0|2,0,0]=4 584 B9R1.15 C=Cc1cccnc1Cl 271570a_100011290941_100000036424 [1,0,1,0,0,0|2,0,0]=4 585 B9R1.15 C=Cc1cccnc1F 271570a_100011290941_100009816115 [1,0,1,0,0,0|2,0,0]=4 586 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [1,0,1,0,0,0|2,0,0]=4 587 B9R1.15 C=Cc1ccncc1Br 271570a_100011290941_100000726257 [1,0,1,0,0,0|2,0,0]=4 588 B9R1.15 C=Cc1ccncc1C 271570a_100011290941_100015191297 [1,0,1,0,0,0|2,0,0]=4 589 B9R1.15 C=Cc1ccncc1Cl 271570a_100011290941_100000708259 [1,0,1,0,0,0|2,0,0]=4 590 B9R1.15 C=Cc1ccncc1F 271570a_100011290941_100000047030 [1,0,1,0,0,0|2,0,0]=4 591 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [1,0,1,0,0,0|2,0,0]=4 592 B9R1.15 C=Cc1ccncc1O 271570a_100011290941_100009817591 [1,0,1,0,0,0|1,0,0]=3 593 B9R1.15 C=Cc1cnccc1Br 271570a_100011290941_100010138639 [1,0,1,0,0,0|2,0,0]=4 594 B9R1.15 C=Cc1cnccc1C 271570a_100011290941_100000761580 [1,0,1,0,0,0|2,0,0]=4 595 B9R1.15 C=Cc1cnccc1Cl 271570a_100011290941_100009995489 [1,0,1,0,0,0|2,0,0]=4 596 B9R1.15 C=Cc1cnccc1F 271570a_100011290941_100009820683 [1,0,1,0,0,0|2,0,0]=4 597 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [1,0,1,0,0,0|2,0,0]=4 598 B9R1.15 C=Cc1cncnc1O 271570a_100011290941_100000751107 [1,0,1,0,0,0|2,0,0]=4 599 B9R1.15 C=Cc1ncccc1Br 271570a_100011290941_100000696092 [1,0,1,0,0,0|2,0,0]=4 600 B9R1.15 C=Cc1ncccc1C 271570a_100011290941_100000751373 [1,0,1,0,0,0|2,0,0]=4 601 B9R1.15 C=Cc1ncccc1Cl 271570a_100011290941_100011356963 [1,0,1,0,0,0|2,0,0]=4 602 B9R1.15 C=Cc1ncccc1F 271570a_100011290941_100000685392 [1,0,1,0,0,0|2,0,0]=4 603 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [1,0,1,0,0,0|2,0,0]=4 604 B9R1.15 C=Cc1ncccc1O 271570a_100011290941_100000034122 [1,0,1,0,0,0|1,0,0]=3 605 B9R1.15 CCc1ccccc1O 271570a_203496583355_100011215823 [1,0,1,0,0,0|0,0,1]=3 606 B9R1.15 CCc1ccncc1O 271570a_203496583355_100009819861 [1,0,1,0,0,0|1,0,1]=4 607 B9R1.15 CCc1cnccc1O 271570a_203496583355_100025704421 [1,0,1,0,0,0|1,0,1]=4 608 B9R1.15 CCc1ncccc1O 271570a_203496583355_100009877225 [1,0,1,0,0,0|1,0,1]=4 609 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [1,0,1,0,0,0|2,0,0]=4 610 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,1,0,0,0|1,0,1]=4 611 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [1,0,1,0,0,0|2,0,0]=4 612 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [1,0,1,0,0,0|2,0,0]=4 613 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [1,0,1,0,0,0|2,0,0]=4 614 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,1,0,0,0|1,0,0]=3 615 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,1,0,0,0|1,0,0]=3 616 B9R1.15 CNc1cccnc1O 271570a_203496583355_200011806188 [1,0,1,0,0,0|2,0,0]=4 617 B9R1.15 CNc1ccncc1O 271570a_203496583355_100010069531 [1,0,1,0,0,0|2,0,0]=4 618 B9R1.15 CNc1ncccc1O 271570a_203496583355_100000700899 [1,0,1,0,0,0|2,0,0]=4 619 B9R1.15 COc1cccc[n+]1[O-] 7a_100000211761_200000210301 [1,0,1,0,0,0|2,0,0]=4 620 B9R1.15 COc1ccccc1Br 34a_100000181306_200000210301 [1,0,1,0,0,0|1,0,0]=3 621 B9R1.15 COc1ccccc1Br 7a_100000181306_200000210301 [1,0,1,0,0,0|1,0,0]=3 622 B9R1.15 COc1ccccc1C 34a_100000210338_200000210301 [1,0,1,0,0,0|0,0,1]=3 623 B9R1.15 COc1ccccc1C 7a_100000210338_200000210301 [1,0,1,0,0,0|0,0,1]=3 624 B9R1.15 COc1ccccc1Cl 34a_100000210172_200000210301 [1,0,1,0,0,0|1,0,0]=3 625 B9R1.15 COc1ccccc1Cl 7a_100000210172_200000210301 [1,0,1,0,0,0|1,0,0]=3 626 B9R1.15 COc1ccccc1F 34a_100000210171_200000210301 [1,0,1,0,0,0|1,0,0]=3 627 B9R1.15 COc1ccccc1F 7a_100000210171_200000210301 [1,0,1,0,0,0|1,0,0]=3 628 B9R1.15 COc1ccccc1I 34a_100000739446_200000210301 [1,0,1,0,0,0|1,0,0]=3 629 B9R1.15 COc1ccccc1I 7a_100000739446_200000210301 [1,0,1,0,0,0|1,0,0]=3 630 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,1,0,0,0|1,0,0]=3 631 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,1,0,0,0|1,0,0]=3 632 B9R1.15 COc1ccccc1O 271570a_203496583355_100000174000 [1,0,1,0,0,0|1,0,0]=3 633 B9R1.15 COc1cccnc1Br 34a_100000744436_200000210301 [1,0,1,0,0,0|2,0,0]=4 634 B9R1.15 COc1cccnc1Br 7a_100000744436_200000210301 [1,0,1,0,0,0|2,0,0]=4 635 B9R1.15 COc1cccnc1C 34a_100000745507_200000210301 [1,0,1,0,0,0|1,0,1]=4 636 B9R1.15 COc1cccnc1C 7a_100000745507_200000210301 [1,0,1,0,0,0|1,0,1]=4 637 B9R1.15 COc1cccnc1Cl 34a_100000757616_200000210301 [1,0,1,0,0,0|2,0,0]=4 638 B9R1.15 COc1cccnc1Cl 7a_100000757616_200000210301 [1,0,1,0,0,0|2,0,0]=4 639 B9R1.15 COc1cccnc1F 34a_100000061740_200000210301 [1,0,1,0,0,0|2,0,0]=4 640 B9R1.15 COc1cccnc1F 7a_100000061740_200000210301 [1,0,1,0,0,0|2,0,0]=4 641 B9R1.15 COc1cccnc1I 34a_100000034122_200000210301 [1,0,1,0,0,0|2,0,0]=4 642 B9R1.15 COc1cccnc1I 7a_100000034122_200000210301 [1,0,1,0,0,0|2,0,0]=4 643 B9R1.15 COc1cccnc1N 34a_100000211975_200000210301 [1,0,1,0,0,0|2,0,0]=4 644 B9R1.15 COc1cccnc1N 7a_100000211975_200000210301 [1,0,1,0,0,0|2,0,0]=4 645 B9R1.15 COc1cccnc1O 271570a_203496583355_100000690851 [1,0,1,0,0,0|2,0,0]=4 646 B9R1.15 COc1cccoc1=O 34a_100000077404_200000210301 [1,0,1,0,0,0|2,0,0]=4 647 B9R1.15 COc1cccoc1=O 7a_100000077404_200000210301 [1,0,1,0,0,0|2,0,0]=4 648 B9R1.15 COc1ccncc1Br 34a_100011996408_200000210301 [1,0,1,0,0,0|2,0,0]=4 649 B9R1.15 COc1ccncc1C 34a_100000694293_200000210301 [1,0,1,0,0,0|1,0,1]=4 650 B9R1.15 COc1ccncc1Cl 34a_100011997054_200000210301 [1,0,1,0,0,0|2,0,0]=4 651 B9R1.15 COc1ccncc1F 34a_200000081243_200000210301 [1,0,1,0,0,0|2,0,0]=4 652 B9R1.15 COc1ccncc1O 271570a_203496583355_100011997281 [1,0,1,0,0,0|2,0,0]=4 653 B9R1.15 COc1cnccc1C 34a_100011997053_200000210301 [1,0,1,0,0,0|1,0,1]=4 654 B9R1.15 COc1cnccc1C 7a_100011997053_200000210301 [1,0,1,0,0,0|1,0,1]=4 655 B9R1.15 COc1cnccc1Cl 34a_100011996695_200000210301 [1,0,1,0,0,0|2,0,0]=4 656 B9R1.15 COc1cnccc1I 34a_100000050107_200000210301 [1,0,1,0,0,0|2,0,0]=4 657 B9R1.15 COc1cnccc1N 34a_100000753702_200000210301 [1,0,1,0,0,0|2,0,0]=4 658 B9R1.15 COc1cnccc1O 271570a_203496583355_100016988167 [1,0,1,0,0,0|2,0,0]=4 659 B9R1.15 COc1coccc1=O 34a_100000060831_200000210301 [1,0,1,0,0,0|2,0,0]=4 660 B9R1.15 COc1ncccc1Cl 34a_100011290957_200000210301 [1,0,1,0,0,0|2,0,0]=4 661 B9R1.15 COc1ncccc1F 34a_100011219419_200000210301 [1,0,1,0,0,0|2,0,0]=4 662 B9R1.15 COc1ncccc1N 34a_100000746358_200000210301 [1,0,1,0,0,0|2,0,0]=4 663 B9R1.15 COc1ncccc1O 271570a_203496583355_100000047025 [1,0,1,0,0,0|2,0,0]=4 664 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [1,0,1,0,0,0|1,1,0]=4 665 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [1,0,1,0,0,0|1,1,0]=4 666 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,1,0,0,0|0,1,1]=4 667 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,1,0,0,0|0,1,1]=4 668 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [1,0,1,0,0,0|1,1,0]=4 669 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [1,0,1,0,0,0|1,1,0]=4 670 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [1,0,1,0,0,0|1,1,0]=4 671 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [1,0,1,0,0,0|1,1,0]=4 672 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [1,0,1,0,0,0|1,1,0]=4 673 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [1,0,1,0,0,0|1,1,0]=4 674 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,1,0,0,0|1,0,0]=3 675 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,1,0,0,0|1,0,0]=3 676 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,1,0,0,0|1,0,0]=3 677 B9R1.15 CSc1cccnc1O 62a_100000760158_200000210301 [1,0,1,0,0,0|2,0,0]=4 678 B9R1.15 CSc1cccnc1O 62a_200000210301_100000760158 [1,0,1,0,0,0|2,0,0]=4 679 B9R1.15 CSc1ccncc1O 62a_100009817591_200000210301 [1,0,1,0,0,0|2,0,0]=4 680 B9R1.15 CSc1ccncc1O 62a_200000210301_100009817591 [1,0,1,0,0,0|2,0,0]=4 681 B9R1.15 CSc1ncccc1O 271570a_203496583355_100011465278 [1,0,1,0,0,0|2,0,0]=4 682 B9R1.15 CSc1ncccc1O 62a_100000034122_200000210301 [1,0,1,0,0,0|2,0,0]=4 683 B9R1.15 CSc1ncccc1O 62a_200000210301_100000034122 [1,0,1,0,0,0|2,0,0]=4 684 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,1,0,0,0|1,0,1]=4 685 B9R1.15 Cc1ccccc1O[13CH3] 34a_100000210338_200025704644 [1,0,1,0,0,0|0,0,1]=3 686 B9R1.15 Cc1ccccc1O[13CH3] 7a_100000210338_200025704644 [1,0,1,0,0,0|0,0,1]=3 687 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,1,0,0,0|0,1,1]=4 688 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,1,0,0,0|0,1,1]=4 689 B9R1.15 Cc1ccncc1O[13CH3] 34a_100011997053_200025704644 [1,0,1,0,0,0|1,0,1]=4 690 B9R1.15 Cc1ccncc1O[13CH3] 7a_100011997053_200025704644 [1,0,1,0,0,0|1,0,1]=4 691 B9R1.15 Cc1cnccc1O[13CH3] 34a_100000694293_200025704644 [1,0,1,0,0,0|1,0,1]=4 692 B9R1.15 Cc1ncccc1O[13CH3] 34a_100000745507_200025704644 [1,0,1,0,0,0|1,0,1]=4 693 B9R1.15 Cc1ncccc1O[13CH3] 7a_100000745507_200025704644 [1,0,1,0,0,0|1,0,1]=4 694 B9R1.15 N#Cc1ccccc1O 271570a_203496583355_100000188569 [1,0,1,0,0,0|1,0,1]=4 695 B9R1.15 NCc1ccccc1O 271570a_203496583355_100000689332 [1,0,1,0,0,0|1,0,1]=4 696 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,1,0,0,0|2,0,0]=4 697 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,1,0,0,0|1,0,0]=3 698 B9R1.15 O=Cc1cccnc1O 271570a_203496583355_100009816751 [1,0,1,0,0,0|2,0,0]=4 699 B9R1.15 O=Cc1ccncc1O 271570a_203496583355_100011934409 [1,0,1,0,0,0|2,0,0]=4 700 B9R1.15 O=Cc1cnccc1O 271570a_203496583355_100000050567 [1,0,1,0,0,0|2,0,0]=4 701 B9R1.15 O=Cc1ncccc1O 271570a_203496583355_100011934733 [1,0,1,0,0,0|2,0,0]=4 702 B9R1.15 OCc1ccccc1O 271570a_203496583355_100000187465 [1,0,1,0,0,0|1,0,1]=4 703 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [1,0,1,0,0,0|2,0,0]=4 704 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [1,0,1,0,0,0|2,0,0]=4 705 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [1,0,1,0,0,0|2,0,0]=4 706 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [1,0,1,0,0,0|2,0,0]=4 707 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,1,0,0,0|1,0,0]=3 708 B9R1.15 [13CH3]Oc1cccc[n+]1[O-] 7a_100000211761_200025704644 [1,0,1,0,0,0|2,0,0]=4 709 B9R1.15 [13CH3]Oc1ccccc1Br 34a_100000181306_200025704644 [1,0,1,0,0,0|1,0,0]=3 710 B9R1.15 [13CH3]Oc1ccccc1Br 7a_100000181306_200025704644 [1,0,1,0,0,0|1,0,0]=3 711 B9R1.15 [13CH3]Oc1ccccc1Cl 34a_100000210172_200025704644 [1,0,1,0,0,0|1,0,0]=3 712 B9R1.15 [13CH3]Oc1ccccc1Cl 7a_100000210172_200025704644 [1,0,1,0,0,0|1,0,0]=3 713 B9R1.15 [13CH3]Oc1ccccc1F 34a_100000210171_200025704644 [1,0,1,0,0,0|1,0,0]=3 714 B9R1.15 [13CH3]Oc1ccccc1F 7a_100000210171_200025704644 [1,0,1,0,0,0|1,0,0]=3 715 B9R1.15 [13CH3]Oc1ccccc1I 34a_100000739446_200025704644 [1,0,1,0,0,0|1,0,0]=3 716 B9R1.15 [13CH3]Oc1ccccc1I 7a_100000739446_200025704644 [1,0,1,0,0,0|1,0,0]=3 717 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,1,0,0,0|1,0,0]=3 718 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,1,0,0,0|1,0,0]=3 719 B9R1.15 [13CH3]Oc1cccnc1Br 34a_100000744436_200025704644 [1,0,1,0,0,0|2,0,0]=4 720 B9R1.15 [13CH3]Oc1cccnc1Br 7a_100000744436_200025704644 [1,0,1,0,0,0|2,0,0]=4 721 B9R1.15 [13CH3]Oc1cccnc1Cl 34a_100000757616_200025704644 [1,0,1,0,0,0|2,0,0]=4 722 B9R1.15 [13CH3]Oc1cccnc1Cl 7a_100000757616_200025704644 [1,0,1,0,0,0|2,0,0]=4 723 B9R1.15 [13CH3]Oc1cccnc1F 34a_100000061740_200025704644 [1,0,1,0,0,0|2,0,0]=4 724 B9R1.15 [13CH3]Oc1cccnc1F 7a_100000061740_200025704644 [1,0,1,0,0,0|2,0,0]=4 725 B9R1.15 [13CH3]Oc1cccnc1I 34a_100000034122_200025704644 [1,0,1,0,0,0|2,0,0]=4 726 B9R1.15 [13CH3]Oc1cccnc1I 7a_100000034122_200025704644 [1,0,1,0,0,0|2,0,0]=4 727 B9R1.15 [13CH3]Oc1cccnc1N 34a_100000211975_200025704644 [1,0,1,0,0,0|2,0,0]=4 728 B9R1.15 [13CH3]Oc1cccnc1N 7a_100000211975_200025704644 [1,0,1,0,0,0|2,0,0]=4 729 B9R1.15 [13CH3]Oc1cccoc1=O 34a_100000077404_200025704644 [1,0,1,0,0,0|2,0,0]=4 730 B9R1.15 [13CH3]Oc1cccoc1=O 7a_100000077404_200025704644 [1,0,1,0,0,0|2,0,0]=4 731 B9R1.15 [13CH3]Oc1ccncc1Br 34a_100011996408_200025704644 [1,0,1,0,0,0|2,0,0]=4 732 B9R1.15 [13CH3]Oc1ccncc1Cl 34a_100011997054_200025704644 [1,0,1,0,0,0|2,0,0]=4 733 B9R1.15 [13CH3]Oc1ccncc1F 34a_200000081243_200025704644 [1,0,1,0,0,0|2,0,0]=4 734 B9R1.15 [13CH3]Oc1cnccc1Cl 34a_100011996695_200025704644 [1,0,1,0,0,0|2,0,0]=4 735 B9R1.15 [13CH3]Oc1cnccc1I 34a_100000050107_200025704644 [1,0,1,0,0,0|2,0,0]=4 736 B9R1.15 [13CH3]Oc1cnccc1N 34a_100000753702_200025704644 [1,0,1,0,0,0|2,0,0]=4 737 B9R1.15 [13CH3]Oc1coccc1=O 34a_100000060831_200025704644 [1,0,1,0,0,0|2,0,0]=4 738 B9R1.15 [13CH3]Oc1ncccc1Cl 34a_100011290957_200025704644 [1,0,1,0,0,0|2,0,0]=4 739 B9R1.15 [13CH3]Oc1ncccc1F 34a_100011219419_200025704644 [1,0,1,0,0,0|2,0,0]=4 740 B9R1.15 [13CH3]Oc1ncccc1N 34a_100000746358_200025704644 [1,0,1,0,0,0|2,0,0]=4 741 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [1,0,1,0,0,0|1,1,0]=4 742 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [1,0,1,0,0,0|1,1,0]=4 743 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [1,0,1,0,0,0|1,1,0]=4 744 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [1,0,1,0,0,0|1,1,0]=4 745 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [1,0,1,0,0,0|1,1,0]=4 746 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [1,0,1,0,0,0|1,1,0]=4 747 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [1,0,1,0,0,0|1,1,0]=4 748 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [1,0,1,0,0,0|1,1,0]=4 749 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,1,0,0,0|1,0,0]=3 750 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,1,0,0,0|1,0,0]=3 751 B9R1.15 [13CH3]Sc1cccnc1O 62a_100000760158_200025704644 [1,0,1,0,0,0|2,0,0]=4 752 B9R1.15 [13CH3]Sc1cccnc1O 62a_200025704644_100000760158 [1,0,1,0,0,0|2,0,0]=4 753 B9R1.15 [13CH3]Sc1ccncc1O 62a_100009817591_200025704644 [1,0,1,0,0,0|2,0,0]=4 754 B9R1.15 [13CH3]Sc1ccncc1O 62a_200025704644_100009817591 [1,0,1,0,0,0|2,0,0]=4 755 B9R1.15 [13CH3]Sc1ncccc1O 62a_100000034122_200025704644 [1,0,1,0,0,0|2,0,0]=4 756 B9R1.15 [13CH3]Sc1ncccc1O 62a_200025704644_100000034122 [1,0,1,0,0,0|2,0,0]=4 757 B9R1.7 C=C=Cc1ccc(s1)C 271570a_100015277604_100000761539 [1,0,1,0,0,0|0,1,1]=4 758 B9R1.7 C=C=Cc1csc(c1)C 271570a_100015277604_100000759034 [1,0,1,0,0,0|0,1,1]=4 759 B9R1.7 CC=Cc1ccc(s1)C 271570a_100016259895_100000761539 [1,0,1,0,0,0|0,1,1]=4 760 B9R1.7 CC=Cc1csc(c1)C 271570a_100016259895_100000759034 [1,0,1,0,0,0|0,1,1]=4 761 B9R1.12 C=CCSc1ccco1 62a_100000210623_100009814098 [1,0,1,0,0,0|1,0,1]=4 762 B9R1.12 C=CCSc1ccco1 62a_100009814098_100000210623 [1,0,1,0,0,0|1,0,1]=4 763 B9R1.12 C=CCSc1ccoc1 62a_100000210623_100011215275 [1,0,1,0,0,0|1,0,1]=4 764 B9R1.12 C=CCSc1ccoc1 62a_100011215275_100000210623 [1,0,1,0,0,0|1,0,1]=4 765 B9R1.14 C=Cc1ccoc1C=O 271570a_100011290941_100000756499 [1,0,1,0,0,0|1,0,0]=3 766 B9R1.14 C=Cc1ccsc1C=O 271570a_100011290941_100000766043 [1,0,1,0,0,0|1,1,0]=4 767 B9R1.14 C=Cc1sccc1C=O 271570a_100011290941_100009816921 [1,0,1,0,0,0|1,1,0]=4 768 B9R1.22 C=Cc1cc(sc1C)C 271570a_100011290941_100000688054 [1,0,1,0,0,0|0,1,1]=4 769 B9R1.22 C=Cc1sc(cc1C)C 271570a_100011290941_100000689295 [1,0,1,0,0,0|0,1,1]=4 770 B11R1.13 C=C=Cc1cccc(c1O)Br 271570a_100015277604_100010084509 [0,1,1,0,0,0|0,0,2]=4 771 B11R1.13 C=C=Cc1cccc(c1O)C 271570a_100015277604_100009817157 [0,1,1,0,0,0|0,0,2]=4 772 B11R1.13 C=C=Cc1cccc(c1O)Cl 271570a_100015277604_100010202889 [0,1,1,0,0,0|0,0,2]=4 773 B11R1.13 C=C=Cc1cccc(c1O)F 271570a_100015277604_100009813666 [0,1,1,0,0,0|0,0,2]=4 774 B11R1.13 C=C=Cc1cccc(c1O)N 271570a_100015277604_100011934915 [0,1,1,0,0,0|0,0,2]=4 775 B11R1.13 C=C=Cc1cccc(c1O)O 271570a_100015277604_100009815950 [0,1,1,0,0,0|0,0,2]=4 776 B11R1.13 CC=Cc1cccc(=O)n1C 271570a_100016259895_100000726605 [0,1,1,0,0,0|2,0,0]=4 777 B11R1.13 CC=Cc1cccc(c1Br)O 271570a_100016259895_100010187914 [0,1,1,0,0,0|1,0,0]=3 778 B11R1.13 CC=Cc1cccc(c1C)Br 271570a_100016259895_100012353703 [0,1,1,0,0,0|1,0,0]=3 779 B11R1.13 CC=Cc1cccc(c1C)C 271570a_100016259895_100011214922 [0,1,1,0,0,0|1,0,0]=3 780 B11R1.13 CC=Cc1cccc(c1C)Cl 271570a_100016259895_100000726075 [0,1,1,0,0,0|1,0,0]=3 781 B11R1.13 CC=Cc1cccc(c1C)F 271570a_100016259895_100011216893 [0,1,1,0,0,0|1,0,0]=3 782 B11R1.13 CC=Cc1cccc(c1C)N 271570a_100016259895_100000761887 [0,1,1,0,0,0|1,0,0]=3 783 B11R1.13 CC=Cc1cccc(c1C)O 271570a_100016259895_100012002258 [0,1,1,0,0,0|1,0,0]=3 784 B11R1.13 CC=Cc1cccc(c1Cl)Br 271570a_100016259895_100010142854 [0,1,1,0,0,0|1,0,0]=3 785 B11R1.13 CC=Cc1cccc(c1Cl)C 271570a_100016259895_200012352035 [0,1,1,0,0,0|1,0,0]=3 786 B11R1.13 CC=Cc1cccc(c1Cl)Cl 271570a_100016259895_100011215384 [0,1,1,0,0,0|1,0,0]=3 787 B11R1.13 CC=Cc1cccc(c1Cl)F 271570a_100016259895_200010234923 [0,1,1,0,0,0|1,0,0]=3 788 B11R1.13 CC=Cc1cccc(c1Cl)O 271570a_100016259895_100000049636 [0,1,1,0,0,0|1,0,0]=3 789 B11R1.13 CC=Cc1cccc(c1F)Br 271570a_100016259895_100000702267 [0,1,1,0,0,0|1,0,0]=3 790 B11R1.13 CC=Cc1cccc(c1F)C 271570a_100016259895_100000717567 [0,1,1,0,0,0|1,0,0]=3 791 B11R1.13 CC=Cc1cccc(c1F)Cl 271570a_100016259895_100011217346 [0,1,1,0,0,0|1,0,0]=3 792 B11R1.13 CC=Cc1cccc(c1F)F 271570a_100016259895_100000694657 [0,1,1,0,0,0|1,0,0]=3 793 B11R1.13 CC=Cc1cccc(c1F)N 271570a_100016259895_100011935091 [0,1,1,0,0,0|1,0,0]=3 794 B11R1.13 CC=Cc1cccc(c1F)O 271570a_100016259895_100009817021 [0,1,1,0,0,0|1,0,0]=3 795 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,1,1,0,0,0|1,0,0]=3 796 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,1,1,0,0,0|1,0,0]=3 797 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,1,1,0,0,0|1,0,0]=3 798 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,1,1,0,0,0|1,0,0]=3 799 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,1,1,0,0,0|1,0,0]=3 800 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,1,1,0,0,0|1,0,0]=3 801 B11R1.13 CC=Cc1cccc(c1O)Br 271570a_100016259895_100010084509 [0,1,1,0,0,0|0,0,0]=2 802 B11R1.13 CC=Cc1cccc(c1O)C 271570a_100016259895_100009817157 [0,1,1,0,0,0|0,0,0]=2 803 B11R1.13 CC=Cc1cccc(c1O)Cl 271570a_100016259895_100010202889 [0,1,1,0,0,0|0,0,0]=2 804 B11R1.13 CC=Cc1cccc(c1O)F 271570a_100016259895_100009813666 [0,1,1,0,0,0|0,0,0]=2 805 B11R1.13 CC=Cc1cccc(c1O)N 271570a_100016259895_100011934915 [0,1,1,0,0,0|0,0,0]=2 806 B11R1.13 CC=Cc1cccc(c1O)O 271570a_100016259895_100009815950 [0,1,1,0,0,0|0,0,0]=2 807 B11R1.13 CC=Cc1cccn(c1=O)C 271570a_100016259895_100000687173 [0,1,1,0,0,0|1,0,1]=4 808 B11R1.13 CC=Cc1ccnc(c1C)C 271570a_100016259895_100009846815 [0,1,1,0,0,0|2,0,0]=4 809 B11R1.13 CC=Cc1ccnc(c1C)Cl 271570a_100016259895_100000047055 [0,1,1,0,0,0|2,0,0]=4 810 B11R1.13 CC=Cc1ccnc(c1C)F 271570a_100016259895_100010006593 [0,1,1,0,0,0|2,0,0]=4 811 B11R1.13 CC=Cc1ccnc(c1C)N 271570a_100016259895_100009865460 [0,1,1,0,0,0|2,0,0]=4 812 B11R1.13 CC=Cc1ccnc(c1C)O 271570a_100016259895_100009858498 [0,1,1,0,0,0|2,0,0]=4 813 B11R1.13 CC=Cc1ccnc(c1Cl)C 271570a_100016259895_100000698670 [0,1,1,0,0,0|2,0,0]=4 814 B11R1.13 CC=Cc1ccnc(c1Cl)Cl 271570a_100016259895_100010246212 [0,1,1,0,0,0|2,0,0]=4 815 B11R1.13 CC=Cc1ccnc(c1Cl)F 271570a_100016259895_100010067886 [0,1,1,0,0,0|2,0,0]=4 816 B11R1.13 CC=Cc1ccnc(c1Cl)N 271570a_100016259895_100010735111 [0,1,1,0,0,0|2,0,0]=4 817 B11R1.13 CC=Cc1ccnc(c1F)Br 271570a_100016259895_200015269031 [0,1,1,0,0,0|2,0,0]=4 818 B11R1.13 CC=Cc1ccnc(c1F)C 271570a_100016259895_100009849794 [0,1,1,0,0,0|2,0,0]=4 819 B11R1.13 CC=Cc1ccnc(c1F)Cl 271570a_100016259895_100010150473 [0,1,1,0,0,0|2,0,0]=4 820 B11R1.13 CC=Cc1ccnc(c1F)F 271570a_100016259895_100010214882 [0,1,1,0,0,0|2,0,0]=4 821 B11R1.13 CC=Cc1ccnc(c1F)N 271570a_100016259895_100010077785 [0,1,1,0,0,0|2,0,0]=4 822 B11R1.13 CC=Cc1ccnc(c1N)C 271570a_100016259895_100009885578 [0,1,1,0,0,0|2,0,0]=4 823 B11R1.13 CC=Cc1ccnc(c1N)N 271570a_100016259895_100000124095 [0,1,1,0,0,0|2,0,0]=4 824 B11R1.13 CC=Cc1cncc(c1C)Br 271570a_100016259895_100010109657 [0,1,1,0,0,0|2,0,0]=4 825 B11R1.13 CC=Cc1cncc(c1C)C 271570a_100016259895_100009864703 [0,1,1,0,0,0|2,0,0]=4 826 B11R1.13 CC=Cc1cncc(c1C)F 271570a_100016259895_100009881546 [0,1,1,0,0,0|2,0,0]=4 827 B11R1.13 CC=Cc1cncc(c1C)N 271570a_100016259895_100011998293 [0,1,1,0,0,0|2,0,0]=4 828 B11R1.13 CC=Cc1cncc(c1N)Br 271570a_100016259895_100011290786 [0,1,1,0,0,0|2,0,0]=4 829 B11R1.13 CC=Cc1cncc(c1N)C 271570a_100016259895_100009818025 [0,1,1,0,0,0|2,0,0]=4 830 B11R1.13 CC=Cc1cncc(c1N)Cl 271570a_100016259895_100000684942 [0,1,1,0,0,0|2,0,0]=4 831 B11R1.13 CC=Cc1cncc(c1N)F 271570a_100016259895_100009880649 [0,1,1,0,0,0|2,0,0]=4 832 B11R1.13 CC=Cc1cncc(c1N)N 271570a_100016259895_100000694774 [0,1,1,0,0,0|2,0,0]=4 833 B11R1.13 CC=Cc1nccc(c1C)C 271570a_100016259895_100009847204 [0,1,1,0,0,0|2,0,0]=4 834 B11R1.13 CC=Cc1nccc(c1C)F 271570a_100016259895_100009846374 [0,1,1,0,0,0|2,0,0]=4 835 B11R1.13 CC=Cc1nccc(c1C)N 271570a_100016259895_100009980296 [0,1,1,0,0,0|2,0,0]=4 836 B11R1.13 CC=Cc1nccc(c1F)C 271570a_100016259895_100009817629 [0,1,1,0,0,0|2,0,0]=4 837 B11R1.13 CC=Cc1nccc(c1F)N 271570a_100016259895_100015205195 [0,1,1,0,0,0|2,0,0]=4 838 B11R1.13 CC=Cc1nccc(c1F)O 271570a_100016259895_100009876375 [0,1,1,0,0,0|2,0,0]=4 839 B11R1.13 CC=Cc1nccc(c1N)C 271570a_100016259895_100000763560 [0,1,1,0,0,0|2,0,0]=4 840 B11R1.13 CC=Cc1nccc(c1N)N 271570a_100016259895_100000085203 [0,1,1,0,0,0|2,0,0]=4 841 B11R1.13 CC=Cc1nccc(c1N)O 271570a_100016259895_100000128729 [0,1,1,0,0,0|2,0,0]=4 842 B11R1.13 CC=Cc1nccc(c1O)C 271570a_100016259895_100000696282 [0,1,1,0,0,0|1,0,0]=3 843 B11R1.13 CC=Cc1nccc(c1O)F 271570a_100016259895_100009867227 [0,1,1,0,0,0|1,0,0]=3 844 B11R1.13 CCNc1cccc(c1O)Br 34a_100011934915_100000210202 [0,1,1,0,0,0|1,0,1]=4 845 B11R1.13 CCNc1cccc(c1O)C 34a_100000756359_100000210202 [0,1,1,0,0,0|1,0,1]=4 846 B11R1.13 CCNc1cccc(c1O)Cl 34a_100000754742_100000210202 [0,1,1,0,0,0|1,0,1]=4 847 B11R1.13 CCNc1cccc(c1O)F 34a_100011934987_100000210202 [0,1,1,0,0,0|1,0,1]=4 848 B11R1.13 CCOc1cccc(c1Br)Br 34a_100010187966_100000210202 [0,1,1,0,0,0|1,0,1]=4 849 B11R1.13 CCOc1cccc(c1Br)Br 7a_100010187966_100000210202 [0,1,1,0,0,0|1,0,1]=4 850 B11R1.13 CCOc1cccc(c1Br)C 34a_100000686692_100000210202 [0,1,1,0,0,0|1,0,1]=4 851 B11R1.13 CCOc1cccc(c1Br)C 7a_100000686692_100000210202 [0,1,1,0,0,0|1,0,1]=4 852 B11R1.13 CCOc1cccc(c1Br)Cl 34a_100012348804_100000210202 [0,1,1,0,0,0|1,0,1]=4 853 B11R1.13 CCOc1cccc(c1Br)Cl 7a_100012348804_100000210202 [0,1,1,0,0,0|1,0,1]=4 854 B11R1.13 CCOc1cccc(c1Br)F 34a_100009820682_100000210202 [0,1,1,0,0,0|1,0,1]=4 855 B11R1.13 CCOc1cccc(c1Br)F 7a_100009820682_100000210202 [0,1,1,0,0,0|1,0,1]=4 856 B11R1.13 CCOc1cccc(c1Br)I 34a_100010187914_100000210202 [0,1,1,0,0,0|1,0,1]=4 857 B11R1.13 CCOc1cccc(c1Br)I 7a_100010187914_100000210202 [0,1,1,0,0,0|1,0,1]=4 858 B11R1.13 CCOc1cccc(c1Br)N 34a_100012183704_100000210202 [0,1,1,0,0,0|1,0,1]=4 859 B11R1.13 CCOc1cccc(c1Br)N 7a_100012183704_100000210202 [0,1,1,0,0,0|1,0,1]=4 860 B11R1.13 CCOc1cccc(c1C)Br 34a_100012002258_100000210202 [0,1,1,0,0,0|0,0,2]=4 861 B11R1.13 CCOc1cccc(c1C)Br 7a_100012002258_100000210202 [0,1,1,0,0,0|0,0,2]=4 862 B11R1.13 CCOc1cccc(c1C)C 34a_100000185855_100000210202 [0,1,1,0,0,0|0,0,2]=4 863 B11R1.13 CCOc1cccc(c1C)C 7a_100000185855_100000210202 [0,1,1,0,0,0|0,0,2]=4 864 B11R1.13 CCOc1cccc(c1C)Cl 34a_100011265684_100000210202 [0,1,1,0,0,0|0,0,2]=4 865 B11R1.13 CCOc1cccc(c1C)Cl 7a_100011265684_100000210202 [0,1,1,0,0,0|0,0,2]=4 866 B11R1.13 CCOc1cccc(c1C)F 34a_100011217231_100000210202 [0,1,1,0,0,0|0,0,2]=4 867 B11R1.13 CCOc1cccc(c1C)F 7a_100011217231_100000210202 [0,1,1,0,0,0|0,0,2]=4 868 B11R1.13 CCOc1cccc(c1C)N 34a_100011216573_100000210202 [0,1,1,0,0,0|0,0,2]=4 869 B11R1.13 CCOc1cccc(c1C)N 7a_100011216573_100000210202 [0,1,1,0,0,0|0,0,2]=4 870 B11R1.13 CCOc1cccc(c1Cl)Br 34a_100010187913_100000210202 [0,1,1,0,0,0|1,0,1]=4 871 B11R1.13 CCOc1cccc(c1Cl)Br 7a_100010187913_100000210202 [0,1,1,0,0,0|1,0,1]=4 872 B11R1.13 CCOc1cccc(c1Cl)C 34a_100000695629_100000210202 [0,1,1,0,0,0|1,0,1]=4 873 B11R1.13 CCOc1cccc(c1Cl)C 7a_100000695629_100000210202 [0,1,1,0,0,0|1,0,1]=4 874 B11R1.13 CCOc1cccc(c1Cl)Cl 34a_100000211076_100000210202 [0,1,1,0,0,0|1,0,1]=4 875 B11R1.13 CCOc1cccc(c1Cl)Cl 7a_100000211076_100000210202 [0,1,1,0,0,0|1,0,1]=4 876 B11R1.13 CCOc1cccc(c1Cl)F 34a_100000087408_100000210202 [0,1,1,0,0,0|1,0,1]=4 877 B11R1.13 CCOc1cccc(c1Cl)F 7a_100000087408_100000210202 [0,1,1,0,0,0|1,0,1]=4 878 B11R1.13 CCOc1cccc(c1Cl)I 34a_100000049636_100000210202 [0,1,1,0,0,0|1,0,1]=4 879 B11R1.13 CCOc1cccc(c1Cl)I 7a_100000049636_100000210202 [0,1,1,0,0,0|1,0,1]=4 880 B11R1.13 CCOc1cccc(c1Cl)N 34a_100012002038_100000210202 [0,1,1,0,0,0|1,0,1]=4 881 B11R1.13 CCOc1cccc(c1Cl)N 7a_100012002038_100000210202 [0,1,1,0,0,0|1,0,1]=4 882 B11R1.13 CCOc1cccc(c1F)Br 34a_100009817021_100000210202 [0,1,1,0,0,0|1,0,1]=4 883 B11R1.13 CCOc1cccc(c1F)Br 7a_100009817021_100000210202 [0,1,1,0,0,0|1,0,1]=4 884 B11R1.13 CCOc1cccc(c1F)C 34a_100000751311_100000210202 [0,1,1,0,0,0|1,0,1]=4 885 B11R1.13 CCOc1cccc(c1F)C 7a_100000751311_100000210202 [0,1,1,0,0,0|1,0,1]=4 886 B11R1.13 CCOc1cccc(c1F)Cl 34a_100000687438_100000210202 [0,1,1,0,0,0|1,0,1]=4 887 B11R1.13 CCOc1cccc(c1F)Cl 7a_100000687438_100000210202 [0,1,1,0,0,0|1,0,1]=4 888 B11R1.13 CCOc1cccc(c1F)F 34a_100000751161_100000210202 [0,1,1,0,0,0|1,0,1]=4 889 B11R1.13 CCOc1cccc(c1F)F 7a_100000751161_100000210202 [0,1,1,0,0,0|1,0,1]=4 890 B11R1.13 CCOc1cccc(c1I)Br 34a_100010187912_100000210202 [0,1,1,0,0,0|1,0,1]=4 891 B11R1.13 CCOc1cccc(c1I)Br 7a_100010187912_100000210202 [0,1,1,0,0,0|1,0,1]=4 892 B11R1.13 CCOc1cccc(c1I)C 34a_100010083724_100000210202 [0,1,1,0,0,0|1,0,1]=4 893 B11R1.13 CCOc1cccc(c1I)C 7a_100010083724_100000210202 [0,1,1,0,0,0|1,0,1]=4 894 B11R1.13 CCOc1cccc(c1I)Cl 34a_100000050174_100000210202 [0,1,1,0,0,0|1,0,1]=4 895 B11R1.13 CCOc1cccc(c1I)Cl 7a_100000050174_100000210202 [0,1,1,0,0,0|1,0,1]=4 896 B11R1.13 CCOc1cccc(c1I)F 34a_100000690913_100000210202 [0,1,1,0,0,0|1,0,1]=4 897 B11R1.13 CCOc1cccc(c1I)F 7a_100000690913_100000210202 [0,1,1,0,0,0|1,0,1]=4 898 B11R1.13 CCOc1cccc(c1N)Br 34a_100011934926_100000210202 [0,1,1,0,0,0|1,0,1]=4 899 B11R1.13 CCOc1cccc(c1N)Br 7a_100011934926_100000210202 [0,1,1,0,0,0|1,0,1]=4 900 B11R1.13 CCOc1cccc(c1N)C 34a_100000743429_100000210202 [0,1,1,0,0,0|1,0,1]=4 901 B11R1.13 CCOc1cccc(c1N)C 7a_100000743429_100000210202 [0,1,1,0,0,0|1,0,1]=4 902 B11R1.13 CCOc1cccc(c1N)Cl 34a_100012022510_100000210202 [0,1,1,0,0,0|1,0,1]=4 903 B11R1.13 CCOc1cccc(c1N)Cl 7a_100012022510_100000210202 [0,1,1,0,0,0|1,0,1]=4 904 B11R1.13 CCOc1cccc(c1N)F 34a_100020591140_100000210202 [0,1,1,0,0,0|1,0,1]=4 905 B11R1.13 CCOc1cccc(c1N)F 7a_100020591140_100000210202 [0,1,1,0,0,0|1,0,1]=4 906 B11R1.13 CCOc1cccc(c1N)I 34a_200000049512_100000210202 [0,1,1,0,0,0|1,0,1]=4 907 B11R1.13 CCOc1cccc(c1N)I 7a_200000049512_100000210202 [0,1,1,0,0,0|1,0,1]=4 908 B11R1.13 CCOc1cccc(c1N)N 34a_100000033209_100000210202 [0,1,1,0,0,0|1,0,1]=4 909 B11R1.13 CCOc1cccc(c1N)O 271570a_203496583355_200103155331 [0,1,1,0,0,0|1,0,1]=4 910 B11R1.13 CCSc1cccc(c1O)Br 62a_100000210202_100010084509 [0,1,1,0,0,0|1,0,1]=4 911 B11R1.13 CCSc1cccc(c1O)Br 62a_100010084509_100000210202 [0,1,1,0,0,0|1,0,1]=4 912 B11R1.13 CCSc1cccc(c1O)C 62a_100000210202_100009817157 [0,1,1,0,0,0|1,0,1]=4 913 B11R1.13 CCSc1cccc(c1O)C 62a_100009817157_100000210202 [0,1,1,0,0,0|1,0,1]=4 914 B11R1.13 CCSc1cccc(c1O)Cl 62a_100000210202_100010202889 [0,1,1,0,0,0|1,0,1]=4 915 B11R1.13 CCSc1cccc(c1O)Cl 62a_100010202889_100000210202 [0,1,1,0,0,0|1,0,1]=4 916 B11R1.13 CCSc1cccc(c1O)F 62a_100000210202_100009813666 [0,1,1,0,0,0|1,0,1]=4 917 B11R1.13 CCSc1cccc(c1O)F 62a_100009813666_100000210202 [0,1,1,0,0,0|1,0,1]=4 918 B11R1.13 CCSc1cccc(c1O)N 62a_100000210202_100010084371 [0,1,1,0,0,0|1,0,1]=4 919 B11R1.13 CCSc1cccc(c1O)N 62a_100011934915_100000210202 [0,1,1,0,0,0|1,0,1]=4 920 B11R1.13 CCSc1cccc(c1O)O 62a_100000210202_100009815950 [0,1,1,0,0,0|1,0,1]=4 921 B11R1.13 CNCc1cccc(c1O)C 34a_100020639391_200000210301 [0,1,1,0,0,0|1,0,1]=4 922 B11R1.13 Cc1cccc(c1O)CN[13CH3] 34a_100020639391_200025704644 [0,1,1,0,0,0|1,0,1]=4 923 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [0,1,1,0,0,0|0,0,2]=4 924 B11R1.17 C=CCOc1ccccc1Br 34a_100000181306_100015514636 [0,1,1,0,0,0|1,0,1]=4 925 B11R1.17 C=CCOc1ccccc1Br 7a_100000181306_100015514636 [0,1,1,0,0,0|1,0,1]=4 926 B11R1.17 C=CCOc1ccccc1C 34a_100000210338_100015514636 [0,1,1,0,0,0|0,0,2]=4 927 B11R1.17 C=CCOc1ccccc1C 7a_100000210338_100015514636 [0,1,1,0,0,0|0,0,2]=4 928 B11R1.17 C=CCOc1ccccc1Cl 34a_100000210172_100015514636 [0,1,1,0,0,0|1,0,1]=4 929 B11R1.17 C=CCOc1ccccc1Cl 7a_100000210172_100015514636 [0,1,1,0,0,0|1,0,1]=4 930 B11R1.17 C=CCOc1ccccc1F 34a_100000210171_100015514636 [0,1,1,0,0,0|1,0,1]=4 931 B11R1.17 C=CCOc1ccccc1F 7a_100000210171_100015514636 [0,1,1,0,0,0|1,0,1]=4 932 B11R1.17 C=CCOc1ccccc1I 34a_100000739446_100015514636 [0,1,1,0,0,0|1,0,1]=4 933 B11R1.17 C=CCOc1ccccc1I 7a_100000739446_100015514636 [0,1,1,0,0,0|1,0,1]=4 934 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,1,1,0,0,0|1,0,1]=4 935 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,1,1,0,0,0|1,0,1]=4 936 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [0,1,1,0,0,0|0,0,2]=4 937 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [0,1,1,0,0,0|0,0,2]=4 938 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [0,1,1,0,0,0|2,0,0]=4 939 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,1,1,0,0,0|1,0,1]=4 940 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [0,1,1,0,0,0|2,0,0]=4 941 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [0,1,1,0,0,0|2,0,0]=4 942 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [0,1,1,0,0,0|2,0,0]=4 943 B11R1.17 CCCCc1ccccc1O 271570a_100020621405_100000739446 [0,1,1,0,0,0|0,0,2]=4 944 B11R1.17 CCCNc1ccccc1O 34a_100000185747_100000210303 [0,1,1,0,0,0|0,0,2]=4 945 B11R1.17 CCCOc1ccccc1Br 34a_100000181306_100000210303 [0,1,1,0,0,0|1,0,1]=4 946 B11R1.17 CCCOc1ccccc1Br 7a_100000181306_100000210303 [0,1,1,0,0,0|1,0,1]=4 947 B11R1.17 CCCOc1ccccc1C 34a_100000210338_100000210303 [0,1,1,0,0,0|0,0,2]=4 948 B11R1.17 CCCOc1ccccc1C 7a_100000210338_100000210303 [0,1,1,0,0,0|0,0,2]=4 949 B11R1.17 CCCOc1ccccc1Cl 34a_100000210172_100000210303 [0,1,1,0,0,0|1,0,1]=4 950 B11R1.17 CCCOc1ccccc1Cl 7a_100000210172_100000210303 [0,1,1,0,0,0|1,0,1]=4 951 B11R1.17 CCCOc1ccccc1F 34a_100000210171_100000210303 [0,1,1,0,0,0|1,0,1]=4 952 B11R1.17 CCCOc1ccccc1F 7a_100000210171_100000210303 [0,1,1,0,0,0|1,0,1]=4 953 B11R1.17 CCCOc1ccccc1I 34a_100000739446_100000210303 [0,1,1,0,0,0|1,0,1]=4 954 B11R1.17 CCCOc1ccccc1I 7a_100000739446_100000210303 [0,1,1,0,0,0|1,0,1]=4 955 B11R1.17 CCCOc1ccccc1N 34a_100000185747_100000210303 [0,1,1,0,0,0|1,0,1]=4 956 B11R1.17 CCCOc1ccccc1N 7a_100000185747_100000210303 [0,1,1,0,0,0|1,0,1]=4 957 B11R1.17 CCCOc1ccccc1O 271570a_203496583355_100000174042 [0,1,1,0,0,0|0,0,2]=4 958 B11R1.17 CCCSc1ccccc1O 62a_100000210303_100000739446 [0,1,1,0,0,0|0,0,2]=4 959 B11R1.17 CCCSc1ccccc1O 62a_100000739446_100000210303 [0,1,1,0,0,0|0,0,2]=4 960 B11R1.17 CCNCc1ccccc1O 34a_100000185550_100000210202 [0,1,1,0,0,0|0,0,2]=4 961 B11R1.17 CCOCc1ccccc1Br 34a_100000756307_100000210202 [0,1,1,0,0,0|1,0,1]=4 962 B11R1.17 CCOCc1ccccc1Br 34a_100121572206_100000184730 [0,1,1,0,0,0|1,0,1]=4 963 B11R1.17 CCOCc1ccccc1Br 7a_100000756307_100000210202 [0,1,1,0,0,0|1,0,1]=4 964 B11R1.17 CCOCc1ccccc1C 34a_100000698903_100000210202 [0,1,1,0,0,0|0,0,2]=4 965 B11R1.17 CCOCc1ccccc1C 34a_100121572206_100000211839 [0,1,1,0,0,0|0,0,2]=4 966 B11R1.17 CCOCc1ccccc1C 7a_100000698903_100000210202 [0,1,1,0,0,0|0,0,2]=4 967 B11R1.17 CCOCc1ccccc1Cl 34a_100000210847_100000210202 [0,1,1,0,0,0|1,0,1]=4 968 B11R1.17 CCOCc1ccccc1Cl 34a_100121572206_100000187162 [0,1,1,0,0,0|1,0,1]=4 969 B11R1.17 CCOCc1ccccc1Cl 7a_100000210847_100000210202 [0,1,1,0,0,0|1,0,1]=4 970 B11R1.17 CCOCc1ccccc1F 34a_100000211962_100000210202 [0,1,1,0,0,0|1,0,1]=4 971 B11R1.17 CCOCc1ccccc1F 34a_100121572206_100000211605 [0,1,1,0,0,0|1,0,1]=4 972 B11R1.17 CCOCc1ccccc1F 7a_100000211962_100000210202 [0,1,1,0,0,0|1,0,1]=4 973 B11R1.17 CCOCc1ccccc1I 34a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 974 B11R1.17 CCOCc1ccccc1I 34a_100121572206_100011215278 [0,1,1,0,0,0|1,0,1]=4 975 B11R1.17 CCOCc1ccccc1I 7a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 976 B11R1.17 CCOCc1ccccc1N 34a_100000212039_100000210202 [0,1,1,0,0,0|1,0,1]=4 977 B11R1.17 CCOCc1ccccc1O 271570a_203496583355_200011493690 [0,1,1,0,0,0|0,0,2]=4 978 B11R1.17 CCSCc1ccccc1O 271570a_203496583355_200000173030 [0,1,1,0,0,0|0,0,2]=4 979 B11R1.17 CNCCc1ccccc1O 34a_100011207237_200000210301 [0,1,1,0,0,0|0,0,2]=4 980 B11R1.17 CNCCc1ccccc1O 34a_100102657272_100000722297 [0,1,1,0,0,0|0,0,2]=4 981 B11R1.17 CNCCc1ccccc1O 7a_106832991635_100000722297 [0,1,1,0,0,0|0,0,2]=4 982 B11R1.17 COCCc1ccccc1O 34a_100138415774_100000722297 [0,1,1,0,0,0|0,0,2]=4 983 B11R1.17 COCOc1ccccc1O 271570a_203496583355_200000230759 [0,1,1,0,0,0|1,0,1]=4 984 B11R1.17 COCSc1ccccc1O 62a_100000739446_100000766300 [0,1,1,0,0,0|1,0,1]=4 985 B11R1.17 COCSc1ccccc1O 62a_100000766300_100000739446 [0,1,1,0,0,0|1,0,1]=4 986 B11R1.17 CSCCc1ccccc1O 62a_100000722297_200000210301 [0,1,1,0,0,0|0,0,2]=4 987 B11R1.17 CSCCc1ccccc1O 62a_200000210301_100000722297 [0,1,1,0,0,0|0,0,2]=4 988 B11R1.17 CSCNc1ccccc1O 34a_100000185747_100011218213 [0,1,1,0,0,0|1,0,1]=4 989 B11R1.17 CSCOc1ccccc1Br 34a_100000181306_100011218213 [0,1,1,0,0,0|1,0,1]=4 990 B11R1.17 CSCOc1ccccc1C 34a_100000210338_100011218213 [0,1,1,0,0,0|0,0,2]=4 991 B11R1.17 CSCOc1ccccc1Cl 34a_100000210172_100011218213 [0,1,1,0,0,0|1,0,1]=4 992 B11R1.17 CSCOc1ccccc1F 34a_100000210171_100011218213 [0,1,1,0,0,0|1,0,1]=4 993 B11R1.17 CSCOc1ccccc1I 34a_100000739446_100011218213 [0,1,1,0,0,0|1,0,1]=4 994 B11R1.17 CSCOc1ccccc1N 34a_100000185747_100011218213 [0,1,1,0,0,0|1,0,1]=4 995 B11R1.17 CSCSc1ccccc1O 62a_100000739446_100011218213 [0,1,1,0,0,0|1,0,1]=4 996 B11R1.17 CSCSc1ccccc1O 62a_100011218213_100000739446 [0,1,1,0,0,0|1,0,1]=4 997 B11R1.17 Cc1ccccc1OCC=O 34a_100000210338_200009817547 [0,1,1,0,0,0|1,0,1]=4 998 B11R1.17 Cc1ccccc1OCC=O 7a_100000210338_200015260668 [0,1,1,0,0,0|1,0,1]=4 999 B11R1.17 Cc1ccccc1OCCF 34a_100000210338_100011217306 [0,1,1,0,0,0|0,0,2]=4 1000 B11R1.17 Cc1ccccc1OCCF 7a_100000210338_100011217306 [0,1,1,0,0,0|0,0,2]=4 1001 B11R1.17 Cc1ccccc1OCCO 34a_100000210338_100000211926 [0,1,1,0,0,0|0,0,2]=4 1002 B11R1.17 Cc1ccccc1OCCO 7a_100000210338_100000211926 [0,1,1,0,0,0|0,0,2]=4 1003 B11R1.17 FCCOc1ccccc1Br 34a_100000181306_100011217306 [0,1,1,0,0,0|1,0,1]=4 1004 B11R1.17 FCCOc1ccccc1Br 7a_100000181306_100011217306 [0,1,1,0,0,0|1,0,1]=4 1005 B11R1.17 FCCOc1ccccc1Cl 34a_100000210172_100011217306 [0,1,1,0,0,0|1,0,1]=4 1006 B11R1.17 FCCOc1ccccc1Cl 7a_100000210172_100011217306 [0,1,1,0,0,0|1,0,1]=4 1007 B11R1.17 FCCOc1ccccc1F 34a_100000210171_100011217306 [0,1,1,0,0,0|1,0,1]=4 1008 B11R1.17 FCCOc1ccccc1F 7a_100000210171_100011217306 [0,1,1,0,0,0|1,0,1]=4 1009 B11R1.17 FCCOc1ccccc1I 34a_100000739446_100011217306 [0,1,1,0,0,0|1,0,1]=4 1010 B11R1.17 FCCOc1ccccc1I 7a_100000739446_100011217306 [0,1,1,0,0,0|1,0,1]=4 1011 B11R1.17 NCCOc1ccccc1O 271570a_203496583355_100000744007 [0,1,1,0,0,0|1,0,1]=4 1012 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,1,0,0,0|2,0,0]=4 1013 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,1,0,0,0|2,0,0]=4 1014 B11R1.17 Nc1ccccc1OCCF 34a_100000185747_100011217306 [0,1,1,0,0,0|1,0,1]=4 1015 B11R1.17 Nc1ccccc1OCCF 7a_100000185747_100011217306 [0,1,1,0,0,0|1,0,1]=4 1016 B11R1.17 Nc1ccccc1OCCO 34a_100000185747_100000211926 [0,1,1,0,0,0|1,0,1]=4 1017 B11R1.17 Nc1ccccc1OCCO 7a_100000185747_100000211926 [0,1,1,0,0,0|1,0,1]=4 1018 B11R1.17 O=CCCc1ccccc1O 271570a_203496583355_100011713448 [0,1,1,0,0,0|1,0,1]=4 1019 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,1,1,0,0,0|1,0,1]=4 1020 B11R1.17 O=CCOc1ccccc1Br 34a_100000181306_200009817547 [0,1,1,0,0,0|2,0,0]=4 1021 B11R1.17 O=CCOc1ccccc1Br 7a_100000181306_200015260668 [0,1,1,0,0,0|2,0,0]=4 1022 B11R1.17 O=CCOc1ccccc1Cl 34a_100000210172_200009817547 [0,1,1,0,0,0|2,0,0]=4 1023 B11R1.17 O=CCOc1ccccc1Cl 7a_100000210172_200015260668 [0,1,1,0,0,0|2,0,0]=4 1024 B11R1.17 O=CCOc1ccccc1F 34a_100000210171_200009817547 [0,1,1,0,0,0|2,0,0]=4 1025 B11R1.17 O=CCOc1ccccc1F 7a_100000210171_200015260668 [0,1,1,0,0,0|2,0,0]=4 1026 B11R1.17 O=CCOc1ccccc1I 34a_100000739446_200009817547 [0,1,1,0,0,0|2,0,0]=4 1027 B11R1.17 O=CCOc1ccccc1I 7a_100000739446_200015260668 [0,1,1,0,0,0|2,0,0]=4 1028 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,1,1,0,0,0|1,0,1]=4 1029 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,1,1,0,0,0|1,0,1]=4 1030 B11R1.17 OCC#Cc1ccccc1O 271570a_203496583355_100009814404 [0,1,1,0,0,0|0,0,2]=4 1031 B11R1.17 OCCCc1ccccc1O 271570a_203496583355_100000699526 [0,1,1,0,0,0|0,0,2]=4 1032 B11R1.17 OCCNc1ccccc1O 34a_100000185747_100000211926 [0,1,1,0,0,0|1,0,1]=4 1033 B11R1.17 OCCOc1ccccc1Br 34a_100000181306_100000211926 [0,1,1,0,0,0|1,0,1]=4 1034 B11R1.17 OCCOc1ccccc1Br 7a_100000181306_100000211926 [0,1,1,0,0,0|1,0,1]=4 1035 B11R1.17 OCCOc1ccccc1Cl 34a_100000210172_100000211926 [0,1,1,0,0,0|1,0,1]=4 1036 B11R1.17 OCCOc1ccccc1Cl 7a_100000210172_100000211926 [0,1,1,0,0,0|1,0,1]=4 1037 B11R1.17 OCCOc1ccccc1F 34a_100000210171_100000211926 [0,1,1,0,0,0|1,0,1]=4 1038 B11R1.17 OCCOc1ccccc1F 7a_100000210171_100000211926 [0,1,1,0,0,0|1,0,1]=4 1039 B11R1.17 OCCOc1ccccc1I 34a_100000739446_100000211926 [0,1,1,0,0,0|1,0,1]=4 1040 B11R1.17 OCCOc1ccccc1I 7a_100000739446_100000211926 [0,1,1,0,0,0|1,0,1]=4 1041 B11R1.17 OCCOc1ccccc1O 271570a_203496583355_100000230753 [0,1,1,0,0,0|1,0,1]=4 1042 B11R1.17 OCCSc1ccccc1O 271570a_203496583355_200000230852 [0,1,1,0,0,0|1,0,1]=4 1043 B11R1.17 OCCSc1ccccc1O 62a_100000211926_100000739446 [0,1,1,0,0,0|1,0,1]=4 1044 B11R1.17 OCCSc1ccccc1O 62a_100000739446_100000211926 [0,1,1,0,0,0|1,0,1]=4 1045 B11R1.17 Oc1ccccc1CNCF 34a_100000185550_100015361967 [0,1,1,0,0,0|1,0,1]=4 1046 B11R1.17 Oc1ccccc1NCCF 34a_100000185747_100011217306 [0,1,1,0,0,0|1,0,1]=4 1047 B11R1.17 Oc1ccccc1SCCF 62a_100000739446_100011217306 [0,1,1,0,0,0|1,0,1]=4 1048 B11R1.17 Oc1ccccc1SCCF 62a_100011217306_100000739446 [0,1,1,0,0,0|1,0,1]=4 1049 B11R1.17 [13CH3]NCCc1ccccc1O 34a_100011207237_200025704644 [0,1,1,0,0,0|0,0,2]=4 1050 B11R1.17 [13CH3]SCCc1ccccc1O 62a_100000722297_200025704644 [0,1,1,0,0,0|0,0,2]=4 1051 B11R1.17 [13CH3]SCCc1ccccc1O 62a_200025704644_100000722297 [0,1,1,0,0,0|0,0,2]=4 1052 B11R1.41 C#Cc1ccccc1OCC 34a_200011470546_100000210202 [0,1,1,0,0,0|0,0,2]=4 1053 B11R1.41 C#Cc1ccccc1OCC 7a_200011470546_100000210202 [0,1,1,0,0,0|0,0,2]=4 1054 B11R1.41 C/C=C/c1ccccc1OC 34a_200000189419_200000210301 [0,1,1,0,0,0|0,0,0]=2 1055 B11R1.41 C/C=C/c1ccccc1OC 7a_200000189419_200000210301 [0,1,1,0,0,0|0,0,0]=2 1056 B11R1.41 C/C=C/c1ccccc1O[13CH3] 34a_200000189419_200025704644 [0,1,1,0,0,0|0,0,0]=2 1057 B11R1.41 C/C=C/c1ccccc1O[13CH3] 7a_200000189419_200025704644 [0,1,1,0,0,0|0,0,0]=2 1058 B11R1.41 C=C=Cc1ccccc1CO 271570a_100015277604_100000187465 [0,1,1,0,0,0|0,0,2]=4 1059 B11R1.41 C=C=Cc1ccccc1OC 271570a_100015277604_100000174000 [0,1,1,0,0,0|0,0,2]=4 1060 B11R1.41 C=CCc1ccccc1C=C 271570a_100011290941_100009828059 [0,1,1,0,0,0|1,0,1]=4 1061 B11R1.41 C=CCc1ccccc1OC 34a_100000211836_200000210301 [0,1,1,0,0,0|0,0,2]=4 1062 B11R1.41 C=CCc1ccccc1OC 7a_100000211836_200000210301 [0,1,1,0,0,0|0,0,2]=4 1063 B11R1.41 C=CCc1ccccc1O[13CH3] 34a_100000211836_200025704644 [0,1,1,0,0,0|0,0,2]=4 1064 B11R1.41 C=CCc1ccccc1O[13CH3] 7a_100000211836_200025704644 [0,1,1,0,0,0|0,0,2]=4 1065 B11R1.41 C=Cc1ccccc1CNC 271570a_100011290941_100000184654 [0,1,1,0,0,0|2,0,0]=4 1066 B11R1.41 C=Cc1ccccc1COC 271570a_100011290941_100011493684 [0,1,1,0,0,0|2,0,0]=4 1067 B11R1.41 C=Cc1ccccc1COC 34a_200010883148_200000210301 [0,1,1,0,0,0|2,0,0]=4 1068 B11R1.41 C=Cc1ccccc1COC 7a_200010883148_200000210301 [0,1,1,0,0,0|2,0,0]=4 1069 B11R1.41 C=Cc1ccccc1CO[13CH3] 34a_200010883148_200025704644 [0,1,1,0,0,0|2,0,0]=4 1070 B11R1.41 C=Cc1ccccc1CO[13CH3] 7a_200010883148_200025704644 [0,1,1,0,0,0|2,0,0]=4 1071 B11R1.41 C=Cc1ccccc1CSC 271570a_100011290941_100000148299 [0,1,1,0,0,0|2,0,0]=4 1072 B11R1.41 C=Cc1ccccc1NCC 271570a_100011290941_114873767003 [0,1,1,0,0,0|1,0,1]=4 1073 B11R1.41 C=Cc1ccccc1NCC 34a_100012022501_100000210202 [0,1,1,0,0,0|1,0,1]=4 1074 B11R1.41 C=Cc1ccccc1OCC 271570a_100011290941_100000230754 [0,1,1,0,0,0|0,0,1]=3 1075 B11R1.41 C=Cc1ccccc1SCC 271570a_100011290941_100000230856 [0,1,1,0,0,0|0,1,1]=4 1076 B11R1.41 C=Cc1ccccc1SCC 62a_100000210202_100011218376 [0,1,1,0,0,0|0,1,1]=4 1077 B11R1.41 C=Cc1ccccc1SCC 62a_100011218376_100000210202 [0,1,1,0,0,0|0,1,1]=4 1078 B11R1.41 C=Cc1cccnc1OCC 271570a_100011290941_100011465154 [0,1,1,0,0,0|1,0,1]=4 1079 B11R1.41 C=Cc1ncccc1OCC 271570a_100011290941_100011597540 [0,1,1,0,0,0|1,0,1]=4 1080 B11R1.41 CC=Cc1ccccc1C#N 271570a_100016259895_100000188569 [0,1,1,0,0,0|1,0,0]=3 1081 B11R1.41 CC=Cc1ccccc1C=O 271570a_100016259895_100000211189 [0,1,1,0,0,0|0,0,1]=3 1082 B11R1.41 CC=Cc1ccccc1CC 271570a_100016259895_100011215823 [0,1,1,0,0,0|1,0,0]=3 1083 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,1,1,0,0,0|1,0,0]=3 1084 B11R1.41 CC=Cc1ccccc1CO 271570a_100016259895_100000187465 [0,1,1,0,0,0|0,0,0]=2 1085 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [0,1,1,0,0,0|1,0,0]=3 1086 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [0,1,1,0,0,0|1,0,0]=3 1087 B11R1.41 CC=Cc1ccccc1OC 271570a_100016259895_100000174000 [0,1,1,0,0,0|0,0,0]=2 1088 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [0,1,1,0,0,0|0,1,0]=3 1089 B11R1.41 CC=Cc1cccnc1C#N 271570a_100016259895_100000685805 [0,1,1,0,0,0|2,0,0]=4 1090 B11R1.41 CC=Cc1cccnc1C=O 271570a_100016259895_100011934733 [0,1,1,0,0,0|1,0,1]=4 1091 B11R1.41 CC=Cc1cccnc1CC 271570a_100016259895_100009877225 [0,1,1,0,0,0|2,0,0]=4 1092 B11R1.41 CC=Cc1cccnc1CN 271570a_100016259895_100020591323 [0,1,1,0,0,0|2,0,0]=4 1093 B11R1.41 CC=Cc1cccnc1CO 271570a_100016259895_100011996772 [0,1,1,0,0,0|1,0,0]=3 1094 B11R1.41 CC=Cc1cccnc1NC 271570a_100016259895_100000700899 [0,1,1,0,0,0|2,0,0]=4 1095 B11R1.41 CC=Cc1cccnc1NN 271570a_100016259895_100011464834 [0,1,1,0,0,0|2,0,0]=4 1096 B11R1.41 CC=Cc1cccnc1OC 271570a_100016259895_100000047025 [0,1,1,0,0,0|1,0,0]=3 1097 B11R1.41 CC=Cc1cccnc1SC 271570a_100016259895_100011465278 [0,1,1,0,0,0|1,1,0]=4 1098 B11R1.41 CC=Cc1ccncc1C#N 271570a_100016259895_100000687039 [0,1,1,0,0,0|2,0,0]=4 1099 B11R1.41 CC=Cc1ccncc1C=O 271570a_100016259895_100000050567 [0,1,1,0,0,0|1,0,1]=4 1100 B11R1.41 CC=Cc1ccncc1CC 271570a_100016259895_100025704421 [0,1,1,0,0,0|2,0,0]=4 1101 B11R1.41 CC=Cc1ccncc1CO 271570a_100016259895_100000117392 [0,1,1,0,0,0|1,0,0]=3 1102 B11R1.41 CC=Cc1ccncc1OC 271570a_100016259895_100016988167 [0,1,1,0,0,0|1,0,0]=3 1103 B11R1.41 CC=Cc1cnccc1C#N 271570a_100016259895_100000684818 [0,1,1,0,0,0|2,0,0]=4 1104 B11R1.41 CC=Cc1cnccc1C=O 271570a_100016259895_100011934409 [0,1,1,0,0,0|1,0,1]=4 1105 B11R1.41 CC=Cc1cnccc1CC 271570a_100016259895_100009819861 [0,1,1,0,0,0|2,0,0]=4 1106 B11R1.41 CC=Cc1cnccc1CN 271570a_100016259895_100020640021 [0,1,1,0,0,0|2,0,0]=4 1107 B11R1.41 CC=Cc1cnccc1CO 271570a_100016259895_100009873359 [0,1,1,0,0,0|1,0,0]=3 1108 B11R1.41 CC=Cc1cnccc1NC 271570a_100016259895_100010069531 [0,1,1,0,0,0|2,0,0]=4 1109 B11R1.41 CC=Cc1cnccc1NN 271570a_100016259895_100013404636 [0,1,1,0,0,0|2,0,0]=4 1110 B11R1.41 CC=Cc1cnccc1OC 271570a_100016259895_100011997281 [0,1,1,0,0,0|1,0,0]=3 1111 B11R1.41 CC=Cc1cncnc1OC 271570a_100016259895_100000719902 [0,1,1,0,0,0|2,0,0]=4 1112 B11R1.41 CC=Cc1ncccc1C#N 271570a_100016259895_100000211984 [0,1,1,0,0,0|2,0,0]=4 1113 B11R1.41 CC=Cc1ncccc1C=O 271570a_100016259895_100009816751 [0,1,1,0,0,0|1,0,1]=4 1114 B11R1.41 CC=Cc1ncccc1CN 271570a_100016259895_100015189234 [0,1,1,0,0,0|2,0,0]=4 1115 B11R1.41 CC=Cc1ncccc1CO 271570a_100016259895_100000748726 [0,1,1,0,0,0|1,0,0]=3 1116 B11R1.41 CC=Cc1ncccc1NC 271570a_100016259895_200011806188 [0,1,1,0,0,0|2,0,0]=4 1117 B11R1.41 CC=Cc1ncccc1OC 271570a_100016259895_100000690851 [0,1,1,0,0,0|1,0,0]=3 1118 B11R1.41 CC=Cc1nccnc1CO 271570a_100016259895_100000057004 [0,1,1,0,0,0|2,0,0]=4 1119 B11R1.41 CC=Cc1nccnc1OC 271570a_100016259895_100000749998 [0,1,1,0,0,0|2,0,0]=4 1120 B11R1.41 CC=Cc1ncncc1OC 271570a_100016259895_100012001275 [0,1,1,0,0,0|2,0,0]=4 1121 B11R1.41 CCCc1ccccc1OC 34a_100011217252_200000210301 [0,1,1,0,0,0|0,0,2]=4 1122 B11R1.41 CCCc1ccccc1OC 7a_100011217252_200000210301 [0,1,1,0,0,0|0,0,2]=4 1123 B11R1.41 CCCc1ccccc1O[13CH3] 34a_100011217252_200025704644 [0,1,1,0,0,0|0,0,2]=4 1124 B11R1.41 CCCc1ccccc1O[13CH3] 7a_100011217252_200025704644 [0,1,1,0,0,0|0,0,2]=4 1125 B11R1.41 CCNc1ccccc1CO 34a_100000212039_100000210202 [0,1,1,0,0,0|1,0,1]=4 1126 B11R1.41 CCNc1ccccc1OC 34a_100000210025_100000210202 [0,1,1,0,0,0|1,0,1]=4 1127 B11R1.41 CCNc1ccccc1OC 34a_103624766699_200000210301 [0,1,1,0,0,0|1,0,1]=4 1128 B11R1.41 CCNc1ccccc1OC 7a_103624766699_200000210301 [0,1,1,0,0,0|1,0,1]=4 1129 B11R1.41 CCNc1ccccc1O[13CH3] 34a_103624766699_200025704644 [0,1,1,0,0,0|1,0,1]=4 1130 B11R1.41 CCNc1ccccc1O[13CH3] 7a_103624766699_200025704644 [0,1,1,0,0,0|1,0,1]=4 1131 B11R1.41 CCOc1ccccc1C#N 34a_100000211048_100000210202 [0,1,1,0,0,0|0,0,2]=4 1132 B11R1.41 CCOc1ccccc1C#N 7a_100000211048_100000210202 [0,1,1,0,0,0|0,0,2]=4 1133 B11R1.41 CCOc1ccccc1CC 34a_100000210936_100000210202 [0,1,1,0,0,0|0,0,2]=4 1134 B11R1.41 CCOc1ccccc1CC 7a_100000210936_100000210202 [0,1,1,0,0,0|0,0,2]=4 1135 B11R1.41 CCOc1ccccc1CN 34a_100000185550_100000210202 [0,1,1,0,0,0|0,0,2]=4 1136 B11R1.41 CCOc1ccccc1CO 34a_100011216872_100000210202 [0,1,1,0,0,0|0,0,2]=4 1137 B11R1.41 CCOc1ccccc1NC 34a_100000033821_100000210202 [0,1,1,0,0,0|0,0,2]=4 1138 B11R1.41 CCOc1ccccc1NC 34a_100000211218_200000210301 [0,1,1,0,0,0|0,0,2]=4 1139 B11R1.41 CCOc1ccccc1N[13CH3] 34a_100000211218_200025704644 [0,1,1,0,0,0|0,0,2]=4 1140 B11R1.41 CCOc1ccccc1OC 34a_100000210385_100000210202 [0,1,1,0,0,0|0,0,2]=4 1141 B11R1.41 CCOc1ccccc1OC 34a_100000211404_200000210301 [0,1,1,0,0,0|0,0,2]=4 1142 B11R1.41 CCOc1ccccc1OC 7a_100000211404_200000210301 [0,1,1,0,0,0|0,0,2]=4 1143 B11R1.41 CCOc1ccccc1O[13CH3] 34a_100000211404_200025704644 [0,1,1,0,0,0|0,0,2]=4 1144 B11R1.41 CCOc1ccccc1O[13CH3] 7a_100000211404_200025704644 [0,1,1,0,0,0|0,0,2]=4 1145 B11R1.41 CCOc1ccccc1SC 34a_100011216402_100000210202 [0,1,1,0,0,0|0,0,2]=4 1146 B11R1.41 CCOc1ccccc1SC 62a_100000230754_200000210301 [0,1,1,0,0,0|0,0,2]=4 1147 B11R1.41 CCOc1ccccc1SC 62a_200000210301_100000230754 [0,1,1,0,0,0|0,0,2]=4 1148 B11R1.41 CCOc1ccccc1S[13CH3] 62a_100000230754_200025704644 [0,1,1,0,0,0|0,0,2]=4 1149 B11R1.41 CCOc1ccccc1S[13CH3] 62a_200025704644_100000230754 [0,1,1,0,0,0|0,0,2]=4 1150 B11R1.41 CCSc1ccccc1C=O 62a_100000210073_100000210202 [0,1,1,0,0,0|0,1,1]=4 1151 B11R1.41 CCSc1ccccc1C=O 62a_100000210202_100000210073 [0,1,1,0,0,0|0,1,1]=4 1152 B11R1.41 CCSc1ccccc1CO 62a_100000187465_100000210202 [0,1,1,0,0,0|1,0,1]=4 1153 B11R1.41 CCSc1ccccc1CO 62a_100000210202_100000187465 [0,1,1,0,0,0|1,0,1]=4 1154 B11R1.41 CCSc1ccccc1OC 62a_100000210202_100000210334 [0,1,1,0,0,0|1,0,1]=4 1155 B11R1.41 CCSc1ccccc1OC 62a_100000210334_100000210202 [0,1,1,0,0,0|1,0,1]=4 1156 B11R1.41 CNCc1ccccc1C=O 2230a_106832991635_200009853537 [0,1,1,0,0,0|2,0,0]=4 1157 B11R1.41 CNCc1ccccc1C=O 34a_100102657272_200009853537 [0,1,1,0,0,0|2,0,0]=4 1158 B11R1.41 CNCc1ccccc1C=O 7a_106832991635_200009853537 [0,1,1,0,0,0|2,0,0]=4 1159 B11R1.41 CNCc1ccccc1CO 2230a_106832991635_100009816955 [0,1,1,0,0,0|1,0,1]=4 1160 B11R1.41 CNCc1ccccc1CO 34a_100102657272_100009816955 [0,1,1,0,0,0|1,0,1]=4 1161 B11R1.41 CNCc1ccccc1CO 7a_106832991635_100009816955 [0,1,1,0,0,0|1,0,1]=4 1162 B11R1.41 CNCc1ccccc1OC 207a_100102657272_100000169842 [0,1,1,0,0,0|1,0,1]=4 1163 B11R1.41 CNCc1ccccc1OC 2230a_106832991635_100000210004 [0,1,1,0,0,0|1,0,1]=4 1164 B11R1.41 CNCc1ccccc1OC 270004a_106832991635_100000169842 [0,1,1,0,0,0|1,0,1]=4 1165 B11R1.41 CNCc1ccccc1OC 34a_100000188900_200000210301 [0,1,1,0,0,0|1,0,1]=4 1166 B11R1.41 CNCc1ccccc1OC 34a_100015189988_200000210301 [0,1,1,0,0,0|1,0,1]=4 1167 B11R1.41 CNCc1ccccc1OC 34a_100102657272_100000210004 [0,1,1,0,0,0|1,0,1]=4 1168 B11R1.41 CNCc1ccccc1OC 7a_106832991635_100000210004 [0,1,1,0,0,0|1,0,1]=4 1169 B11R1.41 CNCc1ccccc1O[13CH3] 34a_100015189988_200025704644 [0,1,1,0,0,0|1,0,1]=4 1170 B11R1.41 COCc1ccccc1C=O 34a_100138415774_200009853537 [0,1,1,0,0,0|2,0,0]=4 1171 B11R1.41 COCc1ccccc1CO 34a_100138415774_100009816955 [0,1,1,0,0,0|1,0,1]=4 1172 B11R1.41 COCc1ccccc1OC 34a_100000211301_200000210301 [0,1,1,0,0,0|1,0,1]=4 1173 B11R1.41 COCc1ccccc1OC 34a_100011488565_200000210301 [0,1,1,0,0,0|1,0,1]=4 1174 B11R1.41 COCc1ccccc1OC 34a_100138415774_100000210004 [0,1,1,0,0,0|1,0,1]=4 1175 B11R1.41 COCc1ccccc1OC 7a_100011488565_200000210301 [0,1,1,0,0,0|1,0,1]=4 1176 B11R1.41 COCc1ccccc1O[13CH3] 34a_100011488565_200025704644 [0,1,1,0,0,0|1,0,1]=4 1177 B11R1.41 COCc1ccccc1O[13CH3] 7a_100011488565_200025704644 [0,1,1,0,0,0|1,0,1]=4 1178 B11R1.41 COc1ccccc1CN[13CH3] 34a_100000188900_200025704644 [0,1,1,0,0,0|1,0,1]=4 1179 B11R1.41 COc1ccccc1CO[13CH3] 34a_100000211301_200025704644 [0,1,1,0,0,0|1,0,1]=4 1180 B11R1.41 COc1ccccc1CSC 62a_100000210004_200000210301 [0,1,1,0,0,0|1,0,1]=4 1181 B11R1.41 COc1ccccc1CSC 62a_200000210301_100000210004 [0,1,1,0,0,0|1,0,1]=4 1182 B11R1.41 COc1ccccc1CS[13CH3] 62a_100000210004_200025704644 [0,1,1,0,0,0|1,0,1]=4 1183 B11R1.41 COc1ccccc1CS[13CH3] 62a_200025704644_100000210004 [0,1,1,0,0,0|1,0,1]=4 1184 B11R1.41 CSCc1ccccc1C=O 62a_200000210301_200009853537 [0,1,1,0,0,0|2,0,0]=4 1185 B11R1.41 CSCc1ccccc1C=O 62a_200009853537_200000210301 [0,1,1,0,0,0|2,0,0]=4 1186 B11R1.41 CSCc1ccccc1CO 62a_100009816955_200000210301 [0,1,1,0,0,0|1,0,1]=4 1187 B11R1.41 CSCc1ccccc1CO 62a_200000210301_100009816955 [0,1,1,0,0,0|1,0,1]=4 1188 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200009853537_200025704644 [0,1,1,0,0,0|2,0,0]=4 1189 B11R1.41 [13CH3]SCc1ccccc1C=O 62a_200025704644_200009853537 [0,1,1,0,0,0|2,0,0]=4 1190 B11R1.41 [13CH3]SCc1ccccc1CO 62a_100009816955_200025704644 [0,1,1,0,0,0|1,0,1]=4 1191 B11R1.41 [13CH3]SCc1ccccc1CO 62a_200025704644_100009816955 [0,1,1,0,0,0|1,0,1]=4 1192 B11R1.81 C=C=Cc1ccc(cc1O)Br 271570a_100015277604_100012344904 [0,1,1,0,0,0|0,0,2]=4 1193 B11R1.81 C=C=Cc1ccc(cc1O)C 271570a_100015277604_100012002257 [0,1,1,0,0,0|0,0,2]=4 1194 B11R1.81 C=C=Cc1ccc(cc1O)Cl 271570a_100015277604_100000050036 [0,1,1,0,0,0|0,0,2]=4 1195 B11R1.81 C=C=Cc1ccc(cc1O)F 271570a_100015277604_100000690578 [0,1,1,0,0,0|0,0,2]=4 1196 B11R1.81 C=C=Cc1ccc(cc1O)O 271570a_100015277604_100009813921 [0,1,1,0,0,0|0,0,2]=4 1197 B11R1.81 CC=Cc1c[nH]c(=O)cc1F 271570a_100016259895_100015631685 [0,1,1,0,0,0|2,0,0]=4 1198 B11R1.81 CC=Cc1cc[n+](cc1C)[O-] 271570a_100016259895_100000074940 [0,1,1,0,0,0|2,0,0]=4 1199 B11R1.81 CC=Cc1ccc(=O)[nH]c1N 271570a_100016259895_100009884077 [0,1,1,0,0,0|2,0,0]=4 1200 B11R1.81 CC=Cc1ccc(c[n+]1[O-])C 271570a_100016259895_100009819918 [0,1,1,0,0,0|1,0,1]=4 1201 B11R1.81 CC=Cc1ccc(c[n+]1[O-])F 271570a_100016259895_100009817261 [0,1,1,0,0,0|1,0,1]=4 1202 B11R1.81 CC=Cc1ccc(cc1Br)Br 271570a_100016259895_100011484698 [0,1,1,0,0,0|1,0,0]=3 1203 B11R1.81 CC=Cc1ccc(cc1Br)C 271570a_100016259895_100009813563 [0,1,1,0,0,0|1,0,0]=3 1204 B11R1.81 CC=Cc1ccc(cc1Br)Cl 271570a_100016259895_100011219703 [0,1,1,0,0,0|1,0,0]=3 1205 B11R1.81 CC=Cc1ccc(cc1Br)F 271570a_100016259895_100011217111 [0,1,1,0,0,0|1,0,0]=3 1206 B11R1.81 CC=Cc1ccc(cc1Br)N 271570a_100016259895_100000750458 [0,1,1,0,0,0|1,0,0]=3 1207 B11R1.81 CC=Cc1ccc(cc1Br)O 271570a_100016259895_100000701344 [0,1,1,0,0,0|1,0,0]=3 1208 B11R1.81 CC=Cc1ccc(cc1C)Br 271570a_100016259895_100000701812 [0,1,1,0,0,0|1,0,0]=3 1209 B11R1.81 CC=Cc1ccc(cc1C)C 271570a_100016259895_100011217332 [0,1,1,0,0,0|1,0,0]=3 1210 B11R1.81 CC=Cc1ccc(cc1C)Cl 271570a_100016259895_100011219607 [0,1,1,0,0,0|1,0,0]=3 1211 B11R1.81 CC=Cc1ccc(cc1C)F 271570a_100016259895_100011205405 [0,1,1,0,0,0|1,0,0]=3 1212 B11R1.81 CC=Cc1ccc(cc1C)N 271570a_100016259895_100000210723 [0,1,1,0,0,0|1,0,0]=3 1213 B11R1.81 CC=Cc1ccc(cc1C)O 271570a_100016259895_100000729255 [0,1,1,0,0,0|1,0,0]=3 1214 B11R1.81 CC=Cc1ccc(cc1Cl)Br 271570a_100016259895_100011216062 [0,1,1,0,0,0|1,0,0]=3 1215 B11R1.81 CC=Cc1ccc(cc1Cl)C 271570a_100016259895_100011263221 [0,1,1,0,0,0|1,0,0]=3 1216 B11R1.81 CC=Cc1ccc(cc1Cl)Cl 271570a_100016259895_100000699841 [0,1,1,0,0,0|1,0,0]=3 1217 B11R1.81 CC=Cc1ccc(cc1Cl)F 271570a_100016259895_100000733362 [0,1,1,0,0,0|1,0,0]=3 1218 B11R1.81 CC=Cc1ccc(cc1Cl)N 271570a_100016259895_100000761885 [0,1,1,0,0,0|1,0,0]=3 1219 B11R1.81 CC=Cc1ccc(cc1Cl)O 271570a_100016259895_100000047559 [0,1,1,0,0,0|1,0,0]=3 1220 B11R1.81 CC=Cc1ccc(cc1F)Br 271570a_100016259895_100009814013 [0,1,1,0,0,0|1,0,0]=3 1221 B11R1.81 CC=Cc1ccc(cc1F)C 271570a_100016259895_100011216119 [0,1,1,0,0,0|1,0,0]=3 1222 B11R1.81 CC=Cc1ccc(cc1F)Cl 271570a_100016259895_100011216042 [0,1,1,0,0,0|1,0,0]=3 1223 B11R1.81 CC=Cc1ccc(cc1F)F 271570a_100016259895_100000750030 [0,1,1,0,0,0|1,0,0]=3 1224 B11R1.81 CC=Cc1ccc(cc1F)N 271570a_100016259895_100011356925 [0,1,1,0,0,0|1,0,0]=3 1225 B11R1.81 CC=Cc1ccc(cc1F)O 271570a_100016259895_100000755031 [0,1,1,0,0,0|1,0,0]=3 1226 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,1,0,0,0|1,0,0]=3 1227 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,1,0,0,0|1,0,0]=3 1228 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,1,0,0,0|1,0,0]=3 1229 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,1,0,0,0|1,0,0]=3 1230 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,1,0,0,0|1,0,0]=3 1231 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,1,0,0,0|1,0,0]=3 1232 B11R1.81 CC=Cc1ccc(cc1O)Br 271570a_100016259895_100012344904 [0,1,1,0,0,0|0,0,0]=2 1233 B11R1.81 CC=Cc1ccc(cc1O)C 271570a_100016259895_100012002257 [0,1,1,0,0,0|0,0,0]=2 1234 B11R1.81 CC=Cc1ccc(cc1O)Cl 271570a_100016259895_100000050036 [0,1,1,0,0,0|0,0,0]=2 1235 B11R1.81 CC=Cc1ccc(cc1O)F 271570a_100016259895_100000690578 [0,1,1,0,0,0|0,0,0]=2 1236 B11R1.81 CC=Cc1ccc(cc1O)O 271570a_100016259895_100009813921 [0,1,1,0,0,0|0,0,0]=2 1237 B11R1.81 CC=Cc1ccc(nc1Br)N 271570a_100016259895_100010734177 [0,1,1,0,0,0|2,0,0]=4 1238 B11R1.81 CC=Cc1ccc(nc1C)C 271570a_100016259895_100009813853 [0,1,1,0,0,0|2,0,0]=4 1239 B11R1.81 CC=Cc1ccc(nc1C)Cl 271570a_100016259895_100000062408 [0,1,1,0,0,0|2,0,0]=4 1240 B11R1.81 CC=Cc1ccc(nc1C)F 271570a_100016259895_100000688911 [0,1,1,0,0,0|2,0,0]=4 1241 B11R1.81 CC=Cc1ccc(nc1C)N 271570a_100016259895_100000013003 [0,1,1,0,0,0|2,0,0]=4 1242 B11R1.81 CC=Cc1ccc(nc1C)O 271570a_100016259895_100000691680 [0,1,1,0,0,0|2,0,0]=4 1243 B11R1.81 CC=Cc1ccc(nc1Cl)Br 271570a_100016259895_100010246183 [0,1,1,0,0,0|2,0,0]=4 1244 B11R1.81 CC=Cc1ccc(nc1Cl)N 271570a_100016259895_100010270343 [0,1,1,0,0,0|2,0,0]=4 1245 B11R1.81 CC=Cc1ccc(nc1F)C 271570a_100016259895_100010006597 [0,1,1,0,0,0|2,0,0]=4 1246 B11R1.81 CC=Cc1ccc(nc1F)Cl 271570a_100016259895_100010168078 [0,1,1,0,0,0|2,0,0]=4 1247 B11R1.81 CC=Cc1ccc(nc1F)F 271570a_100016259895_100000070099 [0,1,1,0,0,0|2,0,0]=4 1248 B11R1.81 CC=Cc1ccc(nc1F)N 271570a_100016259895_100009882772 [0,1,1,0,0,0|2,0,0]=4 1249 B11R1.81 CC=Cc1ccc(nc1F)O 271570a_100016259895_100009879308 [0,1,1,0,0,0|2,0,0]=4 1250 B11R1.81 CC=Cc1ccc(nc1N)C 271570a_100016259895_100009816662 [0,1,1,0,0,0|2,0,0]=4 1251 B11R1.81 CC=Cc1ccc(nc1N)Cl 271570a_100016259895_100010171640 [0,1,1,0,0,0|2,0,0]=4 1252 B11R1.81 CC=Cc1ccc(nc1N)F 271570a_100016259895_100009854977 [0,1,1,0,0,0|2,0,0]=4 1253 B11R1.81 CC=Cc1ccc(nc1N)N 271570a_100016259895_100011356871 [0,1,1,0,0,0|2,0,0]=4 1254 B11R1.81 CC=Cc1ccc(nc1O)C 271570a_100016259895_100009817604 [0,1,1,0,0,0|1,0,0]=3 1255 B11R1.81 CC=Cc1cnc(cc1Br)F 271570a_100016259895_100015451857 [0,1,1,0,0,0|2,0,0]=4 1256 B11R1.81 CC=Cc1cnc(cc1Br)N 271570a_100016259895_100010074611 [0,1,1,0,0,0|2,0,0]=4 1257 B11R1.81 CC=Cc1cnc(cc1C)Br 271570a_100016259895_100009816104 [0,1,1,0,0,0|2,0,0]=4 1258 B11R1.81 CC=Cc1cnc(cc1C)C 271570a_100016259895_100009819613 [0,1,1,0,0,0|2,0,0]=4 1259 B11R1.81 CC=Cc1cnc(cc1C)Cl 271570a_100016259895_100010172789 [0,1,1,0,0,0|2,0,0]=4 1260 B11R1.81 CC=Cc1cnc(cc1C)F 271570a_100016259895_100009820716 [0,1,1,0,0,0|2,0,0]=4 1261 B11R1.81 CC=Cc1cnc(cc1C)N 271570a_100016259895_100000050067 [0,1,1,0,0,0|2,0,0]=4 1262 B11R1.81 CC=Cc1cnc(cc1C)O 271570a_100016259895_100010114363 [0,1,1,0,0,0|2,0,0]=4 1263 B11R1.81 CC=Cc1cnc(cc1Cl)Br 271570a_100016259895_100010381092 [0,1,1,0,0,0|2,0,0]=4 1264 B11R1.81 CC=Cc1cnc(cc1Cl)Cl 271570a_100016259895_100010200927 [0,1,1,0,0,0|2,0,0]=4 1265 B11R1.81 CC=Cc1cnc(cc1Cl)N 271570a_100016259895_100000694920 [0,1,1,0,0,0|2,0,0]=4 1266 B11R1.81 CC=Cc1cnc(cc1F)Cl 271570a_100016259895_100010128100 [0,1,1,0,0,0|2,0,0]=4 1267 B11R1.81 CC=Cc1cnc(cc1F)N 271570a_100016259895_100009844730 [0,1,1,0,0,0|2,0,0]=4 1268 B11R1.81 CC=Cc1cnc(cc1N)C 271570a_100016259895_100009817891 [0,1,1,0,0,0|2,0,0]=4 1269 B11R1.81 CC=Cc1cnc(cc1N)N 271570a_100016259895_200009857908 [0,1,1,0,0,0|2,0,0]=4 1270 B11R1.81 CC=Cc1cnc(cc1O)C 271570a_100016259895_100011016184 [0,1,1,0,0,0|1,0,0]=3 1271 B11R1.81 CC=Cc1ncc(cc1Br)Cl 271570a_100016259895_100012154958 [0,1,1,0,0,0|2,0,0]=4 1272 B11R1.81 CC=Cc1ncc(cc1C)Br 271570a_100016259895_100012353652 [0,1,1,0,0,0|2,0,0]=4 1273 B11R1.81 CC=Cc1ncc(cc1C)C 271570a_100016259895_100009864548 [0,1,1,0,0,0|2,0,0]=4 1274 B11R1.81 CC=Cc1ncc(cc1C)F 271570a_100016259895_100009817009 [0,1,1,0,0,0|2,0,0]=4 1275 B11R1.81 CC=Cc1ncc(cc1C)N 271570a_100016259895_100000761747 [0,1,1,0,0,0|2,0,0]=4 1276 B11R1.81 CC=Cc1ncc(cc1C)O 271570a_100016259895_100012000486 [0,1,1,0,0,0|2,0,0]=4 1277 B11R1.81 CC=Cc1ncc(cc1F)Br 271570a_100016259895_100012348576 [0,1,1,0,0,0|2,0,0]=4 1278 B11R1.81 CC=Cc1ncc(cc1F)C 271570a_100016259895_100009819633 [0,1,1,0,0,0|2,0,0]=4 1279 B11R1.81 CC=Cc1ncc(cc1F)Cl 271570a_100016259895_100012348686 [0,1,1,0,0,0|2,0,0]=4 1280 B11R1.81 CC=Cc1ncc(cc1F)F 271570a_100016259895_100011219543 [0,1,1,0,0,0|2,0,0]=4 1281 B11R1.81 CC=Cc1ncc(cc1F)N 271570a_100016259895_100010280766 [0,1,1,0,0,0|2,0,0]=4 1282 B11R1.81 CC=Cc1ncc(cc1F)O 271570a_100016259895_100000063512 [0,1,1,0,0,0|2,0,0]=4 1283 B11R1.81 CC=Cc1ncc(cc1N)Br 271570a_100016259895_100010090555 [0,1,1,0,0,0|2,0,0]=4 1284 B11R1.81 CC=Cc1ncc(cc1N)C 271570a_100016259895_100000733613 [0,1,1,0,0,0|2,0,0]=4 1285 B11R1.81 CC=Cc1ncc(cc1N)F 271570a_100016259895_100009817643 [0,1,1,0,0,0|2,0,0]=4 1286 B11R1.81 CC=Cc1ncc(cc1N)N 271570a_100016259895_200000093520 [0,1,1,0,0,0|2,0,0]=4 1287 B11R1.81 CC=Cc1ncc(cc1O)Br 271570a_100016259895_100010210634 [0,1,1,0,0,0|1,0,0]=3 1288 B11R1.81 CC=Cc1ncc(cc1O)C 271570a_100016259895_100012000487 [0,1,1,0,0,0|1,0,0]=3 1289 B11R1.81 CC=Cc1ncc(cc1O)Cl 271570a_100016259895_100010233512 [0,1,1,0,0,0|1,0,0]=3 1290 B11R1.81 CC=Cc1ncc(cc1O)F 271570a_100016259895_100000079967 [0,1,1,0,0,0|1,0,0]=3 1291 B11R1.81 CCNc1ccc(cc1O)Br 34a_100000739049_100000210202 [0,1,1,0,0,0|1,0,1]=4 1292 B11R1.81 CCNc1ccc(cc1O)C 34a_100000211527_100000210202 [0,1,1,0,0,0|1,0,1]=4 1293 B11R1.81 CCNc1ccc(cc1O)Cl 34a_100000185728_100000210202 [0,1,1,0,0,0|1,0,1]=4 1294 B11R1.81 CCNc1ccc(cc1O)F 34a_100000753323_100000210202 [0,1,1,0,0,0|1,0,1]=4 1295 B11R1.81 CCNc1ccc(cc1O)O 34a_100000106777_100000210202 [0,1,1,0,0,0|1,0,1]=4 1296 B11R1.81 CCOc1ccc(cc1Br)Br 34a_100000188717_100000210202 [0,1,1,0,0,0|1,0,1]=4 1297 B11R1.81 CCOc1ccc(cc1Br)Br 7a_100000188717_100000210202 [0,1,1,0,0,0|1,0,1]=4 1298 B11R1.81 CCOc1ccc(cc1Br)C 34a_100000210800_100000210202 [0,1,1,0,0,0|1,0,1]=4 1299 B11R1.81 CCOc1ccc(cc1Br)C 7a_100000210800_100000210202 [0,1,1,0,0,0|1,0,1]=4 1300 B11R1.81 CCOc1ccc(cc1Br)Cl 34a_100000211998_100000210202 [0,1,1,0,0,0|1,0,1]=4 1301 B11R1.81 CCOc1ccc(cc1Br)Cl 7a_100000211998_100000210202 [0,1,1,0,0,0|1,0,1]=4 1302 B11R1.81 CCOc1ccc(cc1Br)F 34a_100000211999_100000210202 [0,1,1,0,0,0|1,0,1]=4 1303 B11R1.81 CCOc1ccc(cc1Br)F 7a_100000211999_100000210202 [0,1,1,0,0,0|1,0,1]=4 1304 B11R1.81 CCOc1ccc(cc1Br)I 34a_100012361655_100000210202 [0,1,1,0,0,0|1,0,1]=4 1305 B11R1.81 CCOc1ccc(cc1Br)I 7a_100012361655_100000210202 [0,1,1,0,0,0|1,0,1]=4 1306 B11R1.81 CCOc1ccc(cc1Br)N 34a_100011534360_100000210202 [0,1,1,0,0,0|1,0,1]=4 1307 B11R1.81 CCOc1ccc(cc1Br)N 7a_100011534360_100000210202 [0,1,1,0,0,0|1,0,1]=4 1308 B11R1.81 CCOc1ccc(cc1C)Br 34a_100000186361_100000210202 [0,1,1,0,0,0|0,0,2]=4 1309 B11R1.81 CCOc1ccc(cc1C)Br 7a_100000186361_100000210202 [0,1,1,0,0,0|0,0,2]=4 1310 B11R1.81 CCOc1ccc(cc1C)C 34a_100000211776_100000210202 [0,1,1,0,0,0|0,0,2]=4 1311 B11R1.81 CCOc1ccc(cc1C)C 7a_100000211776_100000210202 [0,1,1,0,0,0|0,0,2]=4 1312 B11R1.81 CCOc1ccc(cc1C)Cl 34a_100000211091_100000210202 [0,1,1,0,0,0|0,0,2]=4 1313 B11R1.81 CCOc1ccc(cc1C)Cl 7a_100000211091_100000210202 [0,1,1,0,0,0|0,0,2]=4 1314 B11R1.81 CCOc1ccc(cc1C)F 34a_100000764316_100000210202 [0,1,1,0,0,0|0,0,2]=4 1315 B11R1.81 CCOc1ccc(cc1C)F 7a_100000764316_100000210202 [0,1,1,0,0,0|0,0,2]=4 1316 B11R1.81 CCOc1ccc(cc1C)I 34a_100011218673_100000210202 [0,1,1,0,0,0|0,0,2]=4 1317 B11R1.81 CCOc1ccc(cc1C)I 7a_100011218673_100000210202 [0,1,1,0,0,0|0,0,2]=4 1318 B11R1.81 CCOc1ccc(cc1C)N 34a_100011218179_100000210202 [0,1,1,0,0,0|0,0,2]=4 1319 B11R1.81 CCOc1ccc(cc1C)N 7a_100011218179_100000210202 [0,1,1,0,0,0|0,0,2]=4 1320 B11R1.81 CCOc1ccc(cc1C)O 271570a_203496583355_100011308936 [0,1,1,0,0,0|0,0,2]=4 1321 B11R1.81 CCOc1ccc(cc1Cl)Br 34a_100000186472_100000210202 [0,1,1,0,0,0|1,0,1]=4 1322 B11R1.81 CCOc1ccc(cc1Cl)Br 7a_100000186472_100000210202 [0,1,1,0,0,0|1,0,1]=4 1323 B11R1.81 CCOc1ccc(cc1Cl)C 34a_100000749699_100000210202 [0,1,1,0,0,0|1,0,1]=4 1324 B11R1.81 CCOc1ccc(cc1Cl)C 7a_100000749699_100000210202 [0,1,1,0,0,0|1,0,1]=4 1325 B11R1.81 CCOc1ccc(cc1Cl)Cl 34a_100015191787_100000210202 [0,1,1,0,0,0|1,0,1]=4 1326 B11R1.81 CCOc1ccc(cc1Cl)Cl 7a_100015191787_100000210202 [0,1,1,0,0,0|1,0,1]=4 1327 B11R1.81 CCOc1ccc(cc1Cl)F 34a_100000212004_100000210202 [0,1,1,0,0,0|1,0,1]=4 1328 B11R1.81 CCOc1ccc(cc1Cl)F 7a_100000212004_100000210202 [0,1,1,0,0,0|1,0,1]=4 1329 B11R1.81 CCOc1ccc(cc1Cl)I 34a_100012360047_100000210202 [0,1,1,0,0,0|1,0,1]=4 1330 B11R1.81 CCOc1ccc(cc1Cl)I 7a_100012360047_100000210202 [0,1,1,0,0,0|1,0,1]=4 1331 B11R1.81 CCOc1ccc(cc1Cl)N 34a_100000744943_100000210202 [0,1,1,0,0,0|1,0,1]=4 1332 B11R1.81 CCOc1ccc(cc1Cl)N 7a_100000744943_100000210202 [0,1,1,0,0,0|1,0,1]=4 1333 B11R1.81 CCOc1ccc(cc1F)Br 34a_100000185481_100000210202 [0,1,1,0,0,0|1,0,1]=4 1334 B11R1.81 CCOc1ccc(cc1F)Br 7a_100000185481_100000210202 [0,1,1,0,0,0|1,0,1]=4 1335 B11R1.81 CCOc1ccc(cc1F)C 34a_100011216688_100000210202 [0,1,1,0,0,0|1,0,1]=4 1336 B11R1.81 CCOc1ccc(cc1F)C 7a_100011216688_100000210202 [0,1,1,0,0,0|1,0,1]=4 1337 B11R1.81 CCOc1ccc(cc1F)Cl 34a_100000230166_100000210202 [0,1,1,0,0,0|1,0,1]=4 1338 B11R1.81 CCOc1ccc(cc1F)Cl 7a_100000230166_100000210202 [0,1,1,0,0,0|1,0,1]=4 1339 B11R1.81 CCOc1ccc(cc1F)F 34a_100000230127_100000210202 [0,1,1,0,0,0|1,0,1]=4 1340 B11R1.81 CCOc1ccc(cc1F)F 7a_100000230127_100000210202 [0,1,1,0,0,0|1,0,1]=4 1341 B11R1.81 CCOc1ccc(cc1F)I 34a_100011356965_100000210202 [0,1,1,0,0,0|1,0,1]=4 1342 B11R1.81 CCOc1ccc(cc1F)I 7a_100011356965_100000210202 [0,1,1,0,0,0|1,0,1]=4 1343 B11R1.81 CCOc1ccc(cc1F)N 34a_100011220035_100000210202 [0,1,1,0,0,0|1,0,1]=4 1344 B11R1.81 CCOc1ccc(cc1F)N 7a_100011220035_100000210202 [0,1,1,0,0,0|1,0,1]=4 1345 B11R1.81 CCOc1ccc(cc1F)O 271570a_203496583355_200000171753 [0,1,1,0,0,0|1,0,1]=4 1346 B11R1.81 CCOc1ccc(cc1I)Br 34a_100012355227_100000210202 [0,1,1,0,0,0|1,0,1]=4 1347 B11R1.81 CCOc1ccc(cc1I)Br 7a_100012355227_100000210202 [0,1,1,0,0,0|1,0,1]=4 1348 B11R1.81 CCOc1ccc(cc1I)C 34a_100000765521_100000210202 [0,1,1,0,0,0|1,0,1]=4 1349 B11R1.81 CCOc1ccc(cc1I)C 7a_100000765521_100000210202 [0,1,1,0,0,0|1,0,1]=4 1350 B11R1.81 CCOc1ccc(cc1I)Cl 34a_100011356953_100000210202 [0,1,1,0,0,0|1,0,1]=4 1351 B11R1.81 CCOc1ccc(cc1I)Cl 7a_100011356953_100000210202 [0,1,1,0,0,0|1,0,1]=4 1352 B11R1.81 CCOc1ccc(cc1I)F 34a_100012355409_100000210202 [0,1,1,0,0,0|1,0,1]=4 1353 B11R1.81 CCOc1ccc(cc1I)F 7a_100012355409_100000210202 [0,1,1,0,0,0|1,0,1]=4 1354 B11R1.81 CCOc1ccc(cc1I)I 7a_100010001573_100000210202 [0,1,1,0,0,0|1,0,1]=4 1355 B11R1.81 CCOc1ccc(cc1N)Br 34a_100000752626_100000210202 [0,1,1,0,0,0|1,0,1]=4 1356 B11R1.81 CCOc1ccc(cc1N)Br 7a_100000752626_100000210202 [0,1,1,0,0,0|1,0,1]=4 1357 B11R1.81 CCOc1ccc(cc1N)C 34a_100011215204_100000210202 [0,1,1,0,0,0|1,0,1]=4 1358 B11R1.81 CCOc1ccc(cc1N)C 7a_100011215204_100000210202 [0,1,1,0,0,0|1,0,1]=4 1359 B11R1.81 CCOc1ccc(cc1N)Cl 34a_100000210500_100000210202 [0,1,1,0,0,0|1,0,1]=4 1360 B11R1.81 CCOc1ccc(cc1N)Cl 7a_100000210500_100000210202 [0,1,1,0,0,0|1,0,1]=4 1361 B11R1.81 CCOc1ccc(cc1N)F 34a_100000759472_100000210202 [0,1,1,0,0,0|1,0,1]=4 1362 B11R1.81 CCOc1ccc(cc1N)F 7a_100000759472_100000210202 [0,1,1,0,0,0|1,0,1]=4 1363 B11R1.81 CCOc1ccc(cc1N)I 34a_100000753495_100000210202 [0,1,1,0,0,0|1,0,1]=4 1364 B11R1.81 CCOc1ccc(cc1N)I 7a_100000753495_100000210202 [0,1,1,0,0,0|1,0,1]=4 1365 B11R1.81 CCOc1ccc(cc1N)N 34a_100000725306_100000210202 [0,1,1,0,0,0|1,0,1]=4 1366 B11R1.81 CCOc1ccc(cc1N)O 271570a_203496583355_100000751366 [0,1,1,0,0,0|1,0,1]=4 1367 B11R1.81 CCOc1ccc(cc1O)C 271570a_203496583355_200000230997 [0,1,1,0,0,0|1,0,1]=4 1368 B11R1.81 CCOc1ccc(cc1O)F 271570a_203496583355_100000171695 [0,1,1,0,0,0|1,0,1]=4 1369 B11R1.81 CCSc1ccc(cc1O)Br 62a_100000210202_100012344904 [0,1,1,0,0,0|1,0,1]=4 1370 B11R1.81 CCSc1ccc(cc1O)Br 62a_100012344904_100000210202 [0,1,1,0,0,0|1,0,1]=4 1371 B11R1.81 CCSc1ccc(cc1O)C 62a_100000210202_100012002257 [0,1,1,0,0,0|1,0,1]=4 1372 B11R1.81 CCSc1ccc(cc1O)C 62a_100012002257_100000210202 [0,1,1,0,0,0|1,0,1]=4 1373 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000050036_100000210202 [0,1,1,0,0,0|1,0,1]=4 1374 B11R1.81 CCSc1ccc(cc1O)Cl 62a_100000210202_100000050036 [0,1,1,0,0,0|1,0,1]=4 1375 B11R1.81 CCSc1ccc(cc1O)F 62a_100000210202_100000690578 [0,1,1,0,0,0|1,0,1]=4 1376 B11R1.81 CCSc1ccc(cc1O)F 62a_100000690578_100000210202 [0,1,1,0,0,0|1,0,1]=4 1377 B11R1.81 CCSc1ccc(cc1O)O 62a_100000210202_100009813921 [0,1,1,0,0,0|1,0,1]=4 1378 B11R1.81 CNCc1ccc(cc1O)F 271570a_203496583355_200011192132 [0,1,1,0,0,0|1,0,1]=4 1379 B11R1.86 CC(=Cc1c[nH]ccc1=O)C 271570a_100102525489_100009998708 [0,1,1,0,0,0|1,0,1]=4 1380 B11R1.86 CC(=Cc1c[nH]ccc1=S)C 271570a_100102525489_200012280681 [0,1,1,0,0,0|1,1,0]=4 1381 B11R1.86 CC(=Cc1ccc[nH]c1=O)C 271570a_100102525489_100000050042 [0,1,1,0,0,0|1,0,1]=4 1382 B11R1.86 CC(=Cc1cccc[n+]1C)C 271570a_100102525489_100000212160 [0,1,1,0,0,0|2,0,0]=4 1383 B11R1.86 CC(=Cc1cccc[n+]1[O-])C 271570a_100102525489_200000042595 [0,1,1,0,0,0|1,0,1]=4 1384 B11R1.86 CC(=Cc1ccccc1Br)C 271570a_100102525489_100000695589 [0,1,1,0,0,0|1,0,0]=3 1385 B11R1.86 CC(=Cc1ccccc1C)C 271570a_100102525489_100000210755 [0,1,1,0,0,0|1,0,0]=3 1386 B11R1.86 CC(=Cc1ccccc1Cl)C 271570a_100102525489_100000764095 [0,1,1,0,0,0|1,0,0]=3 1387 B11R1.86 CC(=Cc1ccccc1F)C 271570a_100102525489_100011215700 [0,1,1,0,0,0|1,0,0]=3 1388 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,1,1,0,0,0|1,0,0]=3 1389 B11R1.86 CC(=Cc1ccccc1O)C 271570a_100102525489_100000739446 [0,1,1,0,0,0|0,0,0]=2 1390 B11R1.86 CC(=Cc1cccnc1Br)C 271570a_100102525489_100010202626 [0,1,1,0,0,0|2,0,0]=4 1391 B11R1.86 CC(=Cc1cccnc1C)C 271570a_100102525489_100000751574 [0,1,1,0,0,0|2,0,0]=4 1392 B11R1.86 CC(=Cc1cccnc1Cl)C 271570a_100102525489_100000036424 [0,1,1,0,0,0|2,0,0]=4 1393 B11R1.86 CC(=Cc1cccnc1F)C 271570a_100102525489_100009816115 [0,1,1,0,0,0|2,0,0]=4 1394 B11R1.86 CC(=Cc1cccnc1N)C 271570a_100102525489_100000045569 [0,1,1,0,0,0|2,0,0]=4 1395 B11R1.86 CC(=Cc1ccncc1Br)C 271570a_100102525489_100000726257 [0,1,1,0,0,0|2,0,0]=4 1396 B11R1.86 CC(=Cc1ccncc1C)C 271570a_100102525489_100015191297 [0,1,1,0,0,0|2,0,0]=4 1397 B11R1.86 CC(=Cc1ccncc1Cl)C 271570a_100102525489_100000708259 [0,1,1,0,0,0|2,0,0]=4 1398 B11R1.86 CC(=Cc1ccncc1F)C 271570a_100102525489_100000047030 [0,1,1,0,0,0|2,0,0]=4 1399 B11R1.86 CC(=Cc1ccncc1N)C 271570a_100102525489_100009815883 [0,1,1,0,0,0|2,0,0]=4 1400 B11R1.86 CC(=Cc1ccncc1O)C 271570a_100102525489_100009817591 [0,1,1,0,0,0|1,0,0]=3 1401 B11R1.86 CC(=Cc1cnccc1Br)C 271570a_100102525489_100010138639 [0,1,1,0,0,0|2,0,0]=4 1402 B11R1.86 CC(=Cc1cnccc1C)C 271570a_100102525489_100000761580 [0,1,1,0,0,0|2,0,0]=4 1403 B11R1.86 CC(=Cc1cnccc1Cl)C 271570a_100102525489_100009995489 [0,1,1,0,0,0|2,0,0]=4 1404 B11R1.86 CC(=Cc1cnccc1F)C 271570a_100102525489_100009820683 [0,1,1,0,0,0|2,0,0]=4 1405 B11R1.86 CC(=Cc1cnccc1N)C 271570a_100102525489_100000047001 [0,1,1,0,0,0|2,0,0]=4 1406 B11R1.86 CC(=Cc1cncnc1O)C 271570a_100102525489_100000751107 [0,1,1,0,0,0|2,0,0]=4 1407 B11R1.86 CC(=Cc1ncccc1Br)C 271570a_100102525489_100000696092 [0,1,1,0,0,0|2,0,0]=4 1408 B11R1.86 CC(=Cc1ncccc1C)C 271570a_100102525489_100000751373 [0,1,1,0,0,0|2,0,0]=4 1409 B11R1.86 CC(=Cc1ncccc1Cl)C 271570a_100102525489_100011356963 [0,1,1,0,0,0|2,0,0]=4 1410 B11R1.86 CC(=Cc1ncccc1F)C 271570a_100102525489_100000685392 [0,1,1,0,0,0|2,0,0]=4 1411 B11R1.86 CC(=Cc1ncccc1N)C 271570a_100102525489_100000688686 [0,1,1,0,0,0|2,0,0]=4 1412 B11R1.86 CC(=Cc1ncccc1O)C 271570a_100102525489_100000034122 [0,1,1,0,0,0|1,0,0]=3 1413 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000070787_100000184730 [0,1,1,0,0,0|1,0,1]=4 1414 B11R1.86 CC(=O)Cc1ccccc1Br 1458a_100000751119_200000210301 [0,1,1,0,0,0|1,0,1]=4 1415 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000070787_100000211839 [0,1,1,0,0,0|1,0,1]=4 1416 B11R1.86 CC(=O)Cc1ccccc1C 1458a_100000212180_200000210301 [0,1,1,0,0,0|1,0,1]=4 1417 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000070787_100000187162 [0,1,1,0,0,0|1,0,1]=4 1418 B11R1.86 CC(=O)Cc1ccccc1Cl 1458a_100000183793_200000210301 [0,1,1,0,0,0|1,0,1]=4 1419 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000070787_100000187165 [0,1,1,0,0,0|1,0,1]=4 1420 B11R1.86 CC(=O)Cc1ccccc1F 1458a_100000212012_200000210301 [0,1,1,0,0,0|1,0,1]=4 1421 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000036491_200000210301 [0,1,1,0,0,0|1,0,1]=4 1422 B11R1.86 CC(=O)Cc1ccccc1I 1458a_100000070787_100011216222 [0,1,1,0,0,0|1,0,1]=4 1423 B11R1.86 CC(=O)Cc1ccccc1O 1458a_100000743006_200000210301 [0,1,1,0,0,0|0,0,1]=3 1424 B11R1.86 CC(=O)Cc1ccccc1O 271570a_203496583355_100011350739 [0,1,1,0,0,0|0,0,1]=3 1425 B11R1.86 CC(=O)Cc1ncccc1O 1458a_100000070787_200020655725 [0,1,1,0,0,0|1,0,1]=4 1426 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,1,1,0,0,0|2,0,0]=4 1427 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,1,1,0,0,0|2,0,0]=4 1428 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,1,1,0,0,0|1,0,1]=4 1429 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,1,1,0,0,0|1,0,1]=4 1430 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,1,1,0,0,0|1,0,1]=4 1431 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,1,1,0,0,0|1,0,1]=4 1432 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,1,1,0,0,0|2,0,0]=4 1433 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,1,1,0,0,0|2,0,0]=4 1434 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,1,1,0,0,0|2,0,0]=4 1435 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,1,1,0,0,0|2,0,0]=4 1436 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,1,1,0,0,0|2,0,0]=4 1437 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,1,1,0,0,0|2,0,0]=4 1438 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,1,1,0,0,0|2,0,0]=4 1439 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,1,1,0,0,0|2,0,0]=4 1440 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,1,1,0,0,0|2,0,0]=4 1441 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,1,1,0,0,0|2,0,0]=4 1442 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,1,1,0,0,0|1,0,0]=3 1443 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,1,1,0,0,0|1,0,0]=3 1444 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,1,1,0,0,0|1,0,0]=3 1445 B11R1.86 CC(=O)Nc1ccncc1O 271570a_203496583355_100016132053 [0,1,1,0,0,0|2,0,0]=4 1446 B11R1.86 CC(=O)Oc1ccccc1O 271570a_203496583355_100000051690 [0,1,1,0,0,0|1,0,0]=3 1447 B11R1.86 CC(=O)Oc1cccnc1O 271570a_203496583355_200009815371 [0,1,1,0,0,0|2,0,0]=4 1448 B11R1.86 CC(C)Nc1ccccc1O 271570a_203496583355_100000219599 [0,1,1,0,0,0|1,0,1]=4 1449 B11R1.86 CC(C)Nc1ccccc1O 34a_100000185747_100000210206 [0,1,1,0,0,0|1,0,1]=4 1450 B11R1.86 CC(C)Oc1ccccc1Br 34a_100000181306_100000210206 [0,1,1,0,0,0|1,0,1]=4 1451 B11R1.86 CC(C)Oc1ccccc1Br 7a_100000181306_100000210206 [0,1,1,0,0,0|1,0,1]=4 1452 B11R1.86 CC(C)Oc1ccccc1Cl 34a_100000210172_100000210206 [0,1,1,0,0,0|1,0,1]=4 1453 B11R1.86 CC(C)Oc1ccccc1Cl 7a_100000210172_100000210206 [0,1,1,0,0,0|1,0,1]=4 1454 B11R1.86 CC(C)Oc1ccccc1F 34a_100000210171_100000210206 [0,1,1,0,0,0|1,0,1]=4 1455 B11R1.86 CC(C)Oc1ccccc1F 7a_100000210171_100000210206 [0,1,1,0,0,0|1,0,1]=4 1456 B11R1.86 CC(C)Oc1ccccc1I 34a_100000739446_100000210206 [0,1,1,0,0,0|1,0,1]=4 1457 B11R1.86 CC(C)Oc1ccccc1I 7a_100000739446_100000210206 [0,1,1,0,0,0|1,0,1]=4 1458 B11R1.86 CC(C)Oc1ccccc1N 34a_100000185747_100000210206 [0,1,1,0,0,0|1,0,1]=4 1459 B11R1.86 CC(C)Oc1ccccc1N 7a_100000185747_100000210206 [0,1,1,0,0,0|1,0,1]=4 1460 B11R1.86 CC(C)Oc1ccccc1O 271570a_203496583355_100000173919 [0,1,1,0,0,0|1,0,1]=4 1461 B11R1.86 CC(C)Sc1ccccc1O 62a_100000210206_100000739446 [0,1,1,0,0,0|1,0,1]=4 1462 B11R1.86 CC(C)Sc1ccccc1O 62a_100000739446_100000210206 [0,1,1,0,0,0|1,0,1]=4 1463 B11R1.86 CN(C)Cc1ccccc1O 2230a_100015189988_200000210301 [0,1,1,0,0,0|1,0,1]=4 1464 B11R1.86 CN(C)Cc1ccccc1O 269982a_100015189988_200000210301 [0,1,1,0,0,0|1,0,1]=4 1465 B11R1.86 CN(C)Cc1ccccc1O 271570a_203496583355_100000174758 [0,1,1,0,0,0|1,0,1]=4 1466 B11R1.86 CN([13CH3])Cc1ccccc1O 2230a_100015189988_200025704644 [0,1,1,0,0,0|1,0,1]=4 1467 B11R1.86 CN([13CH3])Cc1ccccc1O 269982a_100015189988_200025704644 [0,1,1,0,0,0|1,0,1]=4 1468 B11R1.86 Cc1ccccc1CC(=O)[13CH3] 1458a_100000212180_200025704644 [0,1,1,0,0,0|1,0,1]=4 1469 B11R1.86 Cc1ccccc1OC(C)C 34a_100000210338_100000210206 [0,1,1,0,0,0|0,0,2]=4 1470 B11R1.86 Cc1ccccc1OC(C)C 7a_100000210338_100000210206 [0,1,1,0,0,0|0,0,2]=4 1471 B11R1.86 NC(=O)Cc1ccccc1O 271570a_203496583355_200009814924 [0,1,1,0,0,0|1,0,1]=4 1472 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,1,1,0,0,0|2,0,0]=4 1473 B11R1.86 [13CH3]C(=O)Cc1ccccc1Br 1458a_100000751119_200025704644 [0,1,1,0,0,0|1,0,1]=4 1474 B11R1.86 [13CH3]C(=O)Cc1ccccc1Cl 1458a_100000183793_200025704644 [0,1,1,0,0,0|1,0,1]=4 1475 B11R1.86 [13CH3]C(=O)Cc1ccccc1F 1458a_100000212012_200025704644 [0,1,1,0,0,0|1,0,1]=4 1476 B11R1.86 [13CH3]C(=O)Cc1ccccc1I 1458a_100000036491_200025704644 [0,1,1,0,0,0|1,0,1]=4 1477 B11R1.86 [13CH3]C(=O)Cc1ccccc1O 1458a_100000743006_200025704644 [0,1,1,0,0,0|0,0,1]=3 1478 B11R1.182 C=C=Cc1cc(ccc1O)Br 271570a_100015277604_100012355227 [0,1,1,0,0,0|0,0,2]=4 1479 B11R1.182 C=C=Cc1cc(ccc1O)C 271570a_100015277604_100000765521 [0,1,1,0,0,0|0,0,2]=4 1480 B11R1.182 C=C=Cc1cc(ccc1O)Cl 271570a_100015277604_100011356953 [0,1,1,0,0,0|0,0,2]=4 1481 B11R1.182 C=C=Cc1cc(ccc1O)F 271570a_100015277604_100000211999 [0,1,1,0,0,0|0,0,2]=4 1482 B11R1.182 C=C=Cc1cc(ccc1O)N 271570a_100015277604_100011534360 [0,1,1,0,0,0|0,0,2]=4 1483 B11R1.182 C=C=Cc1cc(ccc1O)O 271570a_100015277604_100009813629 [0,1,1,0,0,0|0,0,2]=4 1484 B11R1.182 CC=Cc1cc(=O)[nH]cc1F 271570a_100016259895_100009817642 [0,1,1,0,0,0|2,0,0]=4 1485 B11R1.182 CC=Cc1cc(c[nH]c1=O)F 271570a_100016259895_100009817720 [0,1,1,0,0,0|1,0,1]=4 1486 B11R1.182 CC=Cc1cc(ccc1Br)Br 271570a_100016259895_100011483371 [0,1,1,0,0,0|1,0,0]=3 1487 B11R1.182 CC=Cc1cc(ccc1Br)C 271570a_100016259895_100012353751 [0,1,1,0,0,0|1,0,0]=3 1488 B11R1.182 CC=Cc1cc(ccc1Br)Cl 271570a_100016259895_100012339723 [0,1,1,0,0,0|1,0,0]=3 1489 B11R1.182 CC=Cc1cc(ccc1Br)F 271570a_100016259895_100011217576 [0,1,1,0,0,0|1,0,0]=3 1490 B11R1.182 CC=Cc1cc(ccc1Br)N 271570a_100016259895_100000750459 [0,1,1,0,0,0|1,0,0]=3 1491 B11R1.182 CC=Cc1cc(ccc1Br)O 271570a_100016259895_100012339312 [0,1,1,0,0,0|1,0,0]=3 1492 B11R1.182 CC=Cc1cc(ccc1C)Br 271570a_100016259895_100011344865 [0,1,1,0,0,0|1,0,0]=3 1493 B11R1.182 CC=Cc1cc(ccc1C)C 271570a_100016259895_100000210833 [0,1,1,0,0,0|1,0,0]=3 1494 B11R1.182 CC=Cc1cc(ccc1C)Cl 271570a_100016259895_100011263213 [0,1,1,0,0,0|1,0,0]=3 1495 B11R1.182 CC=Cc1cc(ccc1C)F 271570a_100016259895_100011218078 [0,1,1,0,0,0|1,0,0]=3 1496 B11R1.182 CC=Cc1cc(ccc1C)N 271570a_100016259895_100000736455 [0,1,1,0,0,0|1,0,0]=3 1497 B11R1.182 CC=Cc1cc(ccc1C)O 271570a_100016259895_100011380479 [0,1,1,0,0,0|1,0,0]=3 1498 B11R1.182 CC=Cc1cc(ccc1Cl)Br 271570a_100016259895_100011772130 [0,1,1,0,0,0|1,0,0]=3 1499 B11R1.182 CC=Cc1cc(ccc1Cl)C 271570a_100016259895_100012356289 [0,1,1,0,0,0|1,0,0]=3 1500 B11R1.182 CC=Cc1cc(ccc1Cl)Cl 271570a_100016259895_100000707729 [0,1,1,0,0,0|1,0,0]=3 1501 B11R1.182 CC=Cc1cc(ccc1Cl)F 271570a_100016259895_100011217299 [0,1,1,0,0,0|1,0,0]=3 1502 B11R1.182 CC=Cc1cc(ccc1Cl)N 271570a_100016259895_100012360549 [0,1,1,0,0,0|1,0,0]=3 1503 B11R1.182 CC=Cc1cc(ccc1Cl)O 271570a_100016259895_100000049588 [0,1,1,0,0,0|1,0,0]=3 1504 B11R1.182 CC=Cc1cc(ccc1F)Br 271570a_100016259895_100011217312 [0,1,1,0,0,0|1,0,0]=3 1505 B11R1.182 CC=Cc1cc(ccc1F)C 271570a_100016259895_100000736223 [0,1,1,0,0,0|1,0,0]=3 1506 B11R1.182 CC=Cc1cc(ccc1F)Cl 271570a_100016259895_100011218116 [0,1,1,0,0,0|1,0,0]=3 1507 B11R1.182 CC=Cc1cc(ccc1F)F 271570a_100016259895_100000750033 [0,1,1,0,0,0|1,0,0]=3 1508 B11R1.182 CC=Cc1cc(ccc1F)N 271570a_100016259895_100000760356 [0,1,1,0,0,0|1,0,0]=3 1509 B11R1.182 CC=Cc1cc(ccc1F)O 271570a_100016259895_100000693481 [0,1,1,0,0,0|1,0,0]=3 1510 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [0,1,1,0,0,0|1,0,0]=3 1511 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [0,1,1,0,0,0|1,0,0]=3 1512 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [0,1,1,0,0,0|1,0,0]=3 1513 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [0,1,1,0,0,0|1,0,0]=3 1514 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [0,1,1,0,0,0|1,0,0]=3 1515 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [0,1,1,0,0,0|1,0,0]=3 1516 B11R1.182 CC=Cc1cc(ccc1O)Br 271570a_100016259895_100012355227 [0,1,1,0,0,0|0,0,0]=2 1517 B11R1.182 CC=Cc1cc(ccc1O)C 271570a_100016259895_100000765521 [0,1,1,0,0,0|0,0,0]=2 1518 B11R1.182 CC=Cc1cc(ccc1O)Cl 271570a_100016259895_100011356953 [0,1,1,0,0,0|0,0,0]=2 1519 B11R1.182 CC=Cc1cc(ccc1O)F 271570a_100016259895_100000211999 [0,1,1,0,0,0|0,0,0]=2 1520 B11R1.182 CC=Cc1cc(ccc1O)N 271570a_100016259895_100011534360 [0,1,1,0,0,0|0,0,0]=2 1521 B11R1.182 CC=Cc1cc(ccc1O)O 271570a_100016259895_100009813629 [0,1,1,0,0,0|0,0,0]=2 1522 B11R1.182 CC=Cc1cc(cnc1Br)N 271570a_100016259895_100010201102 [0,1,1,0,0,0|2,0,0]=4 1523 B11R1.182 CC=Cc1cc(cnc1C)Br 271570a_100016259895_200010090566 [0,1,1,0,0,0|2,0,0]=4 1524 B11R1.182 CC=Cc1cc(cnc1C)C 271570a_100016259895_100009817436 [0,1,1,0,0,0|2,0,0]=4 1525 B11R1.182 CC=Cc1cc(cnc1C)F 271570a_100016259895_100009860710 [0,1,1,0,0,0|2,0,0]=4 1526 B11R1.182 CC=Cc1cc(cnc1C)N 271570a_100016259895_100011998591 [0,1,1,0,0,0|2,0,0]=4 1527 B11R1.182 CC=Cc1cc(cnc1C)O 271570a_100016259895_100009819603 [0,1,1,0,0,0|2,0,0]=4 1528 B11R1.182 CC=Cc1cc(cnc1Cl)Br 271570a_100016259895_100009814771 [0,1,1,0,0,0|2,0,0]=4 1529 B11R1.182 CC=Cc1cc(cnc1Cl)C 271570a_100016259895_100010210167 [0,1,1,0,0,0|2,0,0]=4 1530 B11R1.182 CC=Cc1cc(cnc1Cl)Cl 271570a_100016259895_200000062399 [0,1,1,0,0,0|2,0,0]=4 1531 B11R1.182 CC=Cc1cc(cnc1Cl)N 271570a_100016259895_100010253917 [0,1,1,0,0,0|2,0,0]=4 1532 B11R1.182 CC=Cc1cc(cnc1F)Br 271570a_100016259895_100010172738 [0,1,1,0,0,0|2,0,0]=4 1533 B11R1.182 CC=Cc1cc(cnc1F)C 271570a_100016259895_100000049784 [0,1,1,0,0,0|2,0,0]=4 1534 B11R1.182 CC=Cc1cc(cnc1F)Cl 271570a_100016259895_100010188783 [0,1,1,0,0,0|2,0,0]=4 1535 B11R1.182 CC=Cc1cc(cnc1F)F 271570a_100016259895_100009820768 [0,1,1,0,0,0|2,0,0]=4 1536 B11R1.182 CC=Cc1cc(cnc1F)N 271570a_100016259895_100009840397 [0,1,1,0,0,0|2,0,0]=4 1537 B11R1.182 CC=Cc1cc(cnc1F)O 271570a_100016259895_100009817267 [0,1,1,0,0,0|2,0,0]=4 1538 B11R1.182 CC=Cc1cc(cnc1N)Br 271570a_100016259895_100000760472 [0,1,1,0,0,0|2,0,0]=4 1539 B11R1.182 CC=Cc1cc(cnc1N)C 271570a_100016259895_100000049664 [0,1,1,0,0,0|2,0,0]=4 1540 B11R1.182 CC=Cc1cc(cnc1N)Cl 271570a_100016259895_100000050159 [0,1,1,0,0,0|2,0,0]=4 1541 B11R1.182 CC=Cc1cc(cnc1N)F 271570a_100016259895_100009814671 [0,1,1,0,0,0|2,0,0]=4 1542 B11R1.182 CC=Cc1cc(cnc1N)N 271570a_100016259895_200011934315 [0,1,1,0,0,0|2,0,0]=4 1543 B11R1.182 CC=Cc1cc(cnc1O)Br 271570a_100016259895_100010197142 [0,1,1,0,0,0|1,0,0]=3 1544 B11R1.182 CC=Cc1cc(cnc1O)C 271570a_100016259895_100000049931 [0,1,1,0,0,0|1,0,0]=3 1545 B11R1.182 CC=Cc1cc(cnc1O)Cl 271570a_100016259895_100010188700 [0,1,1,0,0,0|1,0,0]=3 1546 B11R1.182 CC=Cc1cc(ncc1Br)Br 271570a_100016259895_100010171693 [0,1,1,0,0,0|2,0,0]=4 1547 B11R1.182 CC=Cc1cc(ncc1Br)Cl 271570a_100016259895_100009815598 [0,1,1,0,0,0|2,0,0]=4 1548 B11R1.182 CC=Cc1cc(ncc1C)Br 271570a_100016259895_100010067628 [0,1,1,0,0,0|2,0,0]=4 1549 B11R1.182 CC=Cc1cc(ncc1C)C 271570a_100016259895_100009862788 [0,1,1,0,0,0|2,0,0]=4 1550 B11R1.182 CC=Cc1cc(ncc1C)Cl 271570a_100016259895_100010068021 [0,1,1,0,0,0|2,0,0]=4 1551 B11R1.182 CC=Cc1cc(ncc1C)F 271570a_100016259895_100000049870 [0,1,1,0,0,0|2,0,0]=4 1552 B11R1.182 CC=Cc1cc(ncc1C)N 271570a_100016259895_100009819938 [0,1,1,0,0,0|2,0,0]=4 1553 B11R1.182 CC=Cc1cc(ncc1C)O 271570a_100016259895_100009831917 [0,1,1,0,0,0|2,0,0]=4 1554 B11R1.182 CC=Cc1cc(ncc1Cl)Br 271570a_100016259895_100010223331 [0,1,1,0,0,0|2,0,0]=4 1555 B11R1.182 CC=Cc1cc(ncc1Cl)Cl 271570a_100016259895_100010172835 [0,1,1,0,0,0|2,0,0]=4 1556 B11R1.182 CC=Cc1cc(ncc1Cl)F 271570a_100016259895_100009892587 [0,1,1,0,0,0|2,0,0]=4 1557 B11R1.182 CC=Cc1cc(ncc1Cl)N 271570a_100016259895_100010134119 [0,1,1,0,0,0|2,0,0]=4 1558 B11R1.182 CC=Cc1cc(ncc1F)Br 271570a_100016259895_100010193852 [0,1,1,0,0,0|2,0,0]=4 1559 B11R1.182 CC=Cc1cc(ncc1F)C 271570a_100016259895_100009867690 [0,1,1,0,0,0|2,0,0]=4 1560 B11R1.182 CC=Cc1cc(ncc1F)Cl 271570a_100016259895_100000708277 [0,1,1,0,0,0|2,0,0]=4 1561 B11R1.182 CC=Cc1cc(ncc1F)F 271570a_100016259895_100010233071 [0,1,1,0,0,0|2,0,0]=4 1562 B11R1.182 CC=Cc1cc(ncc1F)N 271570a_100016259895_100015713587 [0,1,1,0,0,0|2,0,0]=4 1563 B11R1.182 CC=Cc1cc(ncc1N)Cl 271570a_100016259895_100000050123 [0,1,1,0,0,0|2,0,0]=4 1564 B11R1.182 CC=Cc1cc(ncc1O)C 271570a_100016259895_100009843476 [0,1,1,0,0,0|1,0,0]=3 1565 B11R1.182 CC=Cc1cc(ncc1O)Cl 271570a_100016259895_100000698892 [0,1,1,0,0,0|1,0,0]=3 1566 B11R1.182 CC=Cc1cc(nnc1O)O 271570a_100016259895_100000759565 [0,1,1,0,0,0|2,0,0]=4 1567 B11R1.182 CC=Cc1cn(ccc1=O)C 271570a_100016259895_100010750718 [0,1,1,0,0,0|1,0,1]=4 1568 B11R1.182 CC=Cc1nc(ccc1Br)N 271570a_100016259895_100010192275 [0,1,1,0,0,0|2,0,0]=4 1569 B11R1.182 CC=Cc1nc(ccc1C)C 271570a_100016259895_100009854376 [0,1,1,0,0,0|2,0,0]=4 1570 B11R1.182 CC=Cc1nc(ccc1C)N 271570a_100016259895_100000126722 [0,1,1,0,0,0|2,0,0]=4 1571 B11R1.182 CC=Cc1nc(ccc1F)C 271570a_100016259895_100009817602 [0,1,1,0,0,0|2,0,0]=4 1572 B11R1.182 CC=Cc1nc(ccc1F)Cl 271570a_100016259895_100010136221 [0,1,1,0,0,0|2,0,0]=4 1573 B11R1.182 CC=Cc1nc(ccc1F)F 271570a_100016259895_100010997973 [0,1,1,0,0,0|2,0,0]=4 1574 B11R1.182 CC=Cc1nc(ccc1F)N 271570a_100016259895_100010892222 [0,1,1,0,0,0|2,0,0]=4 1575 B11R1.182 CC=Cc1nc(ccc1N)Br 271570a_100016259895_100010168765 [0,1,1,0,0,0|2,0,0]=4 1576 B11R1.182 CC=Cc1nc(ccc1N)C 271570a_100016259895_100000685570 [0,1,1,0,0,0|2,0,0]=4 1577 B11R1.182 CC=Cc1nc(ccc1N)Cl 271570a_100016259895_100010233647 [0,1,1,0,0,0|2,0,0]=4 1578 B11R1.182 CC=Cc1nc(ccc1N)F 271570a_100016259895_100009879877 [0,1,1,0,0,0|2,0,0]=4 1579 B11R1.182 CC=Cc1nc(ccc1N)N 271570a_100016259895_200009884323 [0,1,1,0,0,0|2,0,0]=4 1580 B11R1.182 CC=Cc1nc(ccc1O)Br 271570a_100016259895_100010253912 [0,1,1,0,0,0|1,0,0]=3 1581 B11R1.182 CC=Cc1nc(ccc1O)C 271570a_100016259895_100000702858 [0,1,1,0,0,0|1,0,0]=3 1582 B11R1.182 CC=Cc1nc(ccc1O)Cl 271570a_100016259895_100000696390 [0,1,1,0,0,0|1,0,0]=3 1583 B11R1.182 CC=Cc1nc(ccc1O)F 271570a_100016259895_100010382442 [0,1,1,0,0,0|1,0,0]=3 1584 B11R1.182 CCNc1cc(ccc1O)Br 34a_100000752626_100000210202 [0,1,1,0,0,0|1,0,1]=4 1585 B11R1.182 CCNc1cc(ccc1O)C 34a_100011215204_100000210202 [0,1,1,0,0,0|1,0,1]=4 1586 B11R1.182 CCNc1cc(ccc1O)Cl 34a_100000210500_100000210202 [0,1,1,0,0,0|1,0,1]=4 1587 B11R1.182 CCNc1cc(ccc1O)F 34a_100000759472_100000210202 [0,1,1,0,0,0|1,0,1]=4 1588 B11R1.182 CCOc1cc(ccc1Br)Br 34a_100011220040_100000210202 [0,1,1,0,0,0|1,0,1]=4 1589 B11R1.182 CCOc1cc(ccc1Br)Br 7a_100011220040_100000210202 [0,1,1,0,0,0|1,0,1]=4 1590 B11R1.182 CCOc1cc(ccc1Br)C 34a_100012002257_100000210202 [0,1,1,0,0,0|1,0,1]=4 1591 B11R1.182 CCOc1cc(ccc1Br)C 7a_100012002257_100000210202 [0,1,1,0,0,0|1,0,1]=4 1592 B11R1.182 CCOc1cc(ccc1Br)Cl 34a_100012339455_100000210202 [0,1,1,0,0,0|1,0,1]=4 1593 B11R1.182 CCOc1cc(ccc1Br)Cl 7a_100012339455_100000210202 [0,1,1,0,0,0|1,0,1]=4 1594 B11R1.182 CCOc1cc(ccc1Br)F 34a_100000690578_100000210202 [0,1,1,0,0,0|1,0,1]=4 1595 B11R1.182 CCOc1cc(ccc1Br)F 7a_100000690578_100000210202 [0,1,1,0,0,0|1,0,1]=4 1596 B11R1.182 CCOc1cc(ccc1Br)I 34a_100012356990_100000210202 [0,1,1,0,0,0|1,0,1]=4 1597 B11R1.182 CCOc1cc(ccc1Br)I 7a_100012356990_100000210202 [0,1,1,0,0,0|1,0,1]=4 1598 B11R1.182 CCOc1cc(ccc1C)Br 34a_100000685420_100000210202 [0,1,1,0,0,0|0,0,2]=4 1599 B11R1.182 CCOc1cc(ccc1C)Br 7a_100000685420_100000210202 [0,1,1,0,0,0|0,0,2]=4 1600 B11R1.182 CCOc1cc(ccc1C)C 34a_100000210931_100000210202 [0,1,1,0,0,0|0,0,2]=4 1601 B11R1.182 CCOc1cc(ccc1C)C 7a_100000210931_100000210202 [0,1,1,0,0,0|0,0,2]=4 1602 B11R1.182 CCOc1cc(ccc1C)Cl 34a_100000756515_100000210202 [0,1,1,0,0,0|0,0,2]=4 1603 B11R1.182 CCOc1cc(ccc1C)Cl 7a_100000756515_100000210202 [0,1,1,0,0,0|0,0,2]=4 1604 B11R1.182 CCOc1cc(ccc1C)F 34a_100000690566_100000210202 [0,1,1,0,0,0|0,0,2]=4 1605 B11R1.182 CCOc1cc(ccc1C)F 7a_100000690566_100000210202 [0,1,1,0,0,0|0,0,2]=4 1606 B11R1.182 CCOc1cc(ccc1C)I 7a_100000766334_100000210202 [0,1,1,0,0,0|0,0,2]=4 1607 B11R1.182 CCOc1cc(ccc1C)N 34a_100000759471_100000210202 [0,1,1,0,0,0|0,0,2]=4 1608 B11R1.182 CCOc1cc(ccc1C)N 7a_100000759471_100000210202 [0,1,1,0,0,0|0,0,2]=4 1609 B11R1.182 CCOc1cc(ccc1C)O 271570a_203496583355_100012361169 [0,1,1,0,0,0|0,0,2]=4 1610 B11R1.182 CCOc1cc(ccc1Cl)Br 34a_100000738945_100000210202 [0,1,1,0,0,0|1,0,1]=4 1611 B11R1.182 CCOc1cc(ccc1Cl)Br 7a_100000738945_100000210202 [0,1,1,0,0,0|1,0,1]=4 1612 B11R1.182 CCOc1cc(ccc1Cl)C 34a_100000211493_100000210202 [0,1,1,0,0,0|1,0,1]=4 1613 B11R1.182 CCOc1cc(ccc1Cl)C 7a_100000211493_100000210202 [0,1,1,0,0,0|1,0,1]=4 1614 B11R1.182 CCOc1cc(ccc1Cl)Cl 34a_100000211422_100000210202 [0,1,1,0,0,0|1,0,1]=4 1615 B11R1.182 CCOc1cc(ccc1Cl)Cl 7a_100000211422_100000210202 [0,1,1,0,0,0|1,0,1]=4 1616 B11R1.182 CCOc1cc(ccc1Cl)F 34a_100000692107_100000210202 [0,1,1,0,0,0|1,0,1]=4 1617 B11R1.182 CCOc1cc(ccc1Cl)F 7a_100000692107_100000210202 [0,1,1,0,0,0|1,0,1]=4 1618 B11R1.182 CCOc1cc(ccc1Cl)I 34a_100011356854_100000210202 [0,1,1,0,0,0|1,0,1]=4 1619 B11R1.182 CCOc1cc(ccc1Cl)I 7a_100011356854_100000210202 [0,1,1,0,0,0|1,0,1]=4 1620 B11R1.182 CCOc1cc(ccc1Cl)N 34a_100011934209_100000210202 [0,1,1,0,0,0|1,0,1]=4 1621 B11R1.182 CCOc1cc(ccc1F)Br 34a_100000686035_100000210202 [0,1,1,0,0,0|1,0,1]=4 1622 B11R1.182 CCOc1cc(ccc1F)Br 7a_100000686035_100000210202 [0,1,1,0,0,0|1,0,1]=4 1623 B11R1.182 CCOc1cc(ccc1F)C 34a_100000759540_100000210202 [0,1,1,0,0,0|1,0,1]=4 1624 B11R1.182 CCOc1cc(ccc1F)C 7a_100000759540_100000210202 [0,1,1,0,0,0|1,0,1]=4 1625 B11R1.182 CCOc1cc(ccc1F)Cl 34a_100000757397_100000210202 [0,1,1,0,0,0|1,0,1]=4 1626 B11R1.182 CCOc1cc(ccc1F)Cl 7a_100000757397_100000210202 [0,1,1,0,0,0|1,0,1]=4 1627 B11R1.182 CCOc1cc(ccc1F)F 34a_100000752141_100000210202 [0,1,1,0,0,0|1,0,1]=4 1628 B11R1.182 CCOc1cc(ccc1F)F 7a_100000752141_100000210202 [0,1,1,0,0,0|1,0,1]=4 1629 B11R1.182 CCOc1cc(ccc1F)I 34a_100009958187_100000210202 [0,1,1,0,0,0|1,0,1]=4 1630 B11R1.182 CCOc1cc(ccc1F)I 7a_100009958187_100000210202 [0,1,1,0,0,0|1,0,1]=4 1631 B11R1.182 CCOc1cc(ccc1F)N 34a_100012017398_100000210202 [0,1,1,0,0,0|1,0,1]=4 1632 B11R1.182 CCOc1cc(ccc1F)N 7a_100012017398_100000210202 [0,1,1,0,0,0|1,0,1]=4 1633 B11R1.182 CCOc1cc(ccc1F)O 271570a_203496583355_200012344967 [0,1,1,0,0,0|1,0,1]=4 1634 B11R1.182 CCOc1cc(ccc1I)Br 34a_100012344904_100000210202 [0,1,1,0,0,0|1,0,1]=4 1635 B11R1.182 CCOc1cc(ccc1I)Br 7a_100012344904_100000210202 [0,1,1,0,0,0|1,0,1]=4 1636 B11R1.182 CCOc1cc(ccc1I)Cl 34a_100000050036_100000210202 [0,1,1,0,0,0|1,0,1]=4 1637 B11R1.182 CCOc1cc(ccc1I)Cl 7a_100000050036_100000210202 [0,1,1,0,0,0|1,0,1]=4 1638 B11R1.182 CCOc1cc(ccc1I)F 34a_100010084537_100000210202 [0,1,1,0,0,0|1,0,1]=4 1639 B11R1.182 CCOc1cc(ccc1I)F 7a_100010084537_100000210202 [0,1,1,0,0,0|1,0,1]=4 1640 B11R1.182 CCOc1cc(ccc1N)Br 34a_100000739049_100000210202 [0,1,1,0,0,0|1,0,1]=4 1641 B11R1.182 CCOc1cc(ccc1N)Br 7a_100000739049_100000210202 [0,1,1,0,0,0|1,0,1]=4 1642 B11R1.182 CCOc1cc(ccc1N)C 34a_100000211527_100000210202 [0,1,1,0,0,0|1,0,1]=4 1643 B11R1.182 CCOc1cc(ccc1N)C 7a_100000211527_100000210202 [0,1,1,0,0,0|1,0,1]=4 1644 B11R1.182 CCOc1cc(ccc1N)Cl 34a_100000185728_100000210202 [0,1,1,0,0,0|1,0,1]=4 1645 B11R1.182 CCOc1cc(ccc1N)Cl 7a_100000185728_100000210202 [0,1,1,0,0,0|1,0,1]=4 1646 B11R1.182 CCOc1cc(ccc1N)F 34a_100000753323_100000210202 [0,1,1,0,0,0|1,0,1]=4 1647 B11R1.182 CCOc1cc(ccc1N)F 7a_100000753323_100000210202 [0,1,1,0,0,0|1,0,1]=4 1648 B11R1.182 CCOc1cc(ccc1N)I 34a_100000057187_100000210202 [0,1,1,0,0,0|1,0,1]=4 1649 B11R1.182 CCOc1cc(ccc1N)I 7a_100000057187_100000210202 [0,1,1,0,0,0|1,0,1]=4 1650 B11R1.182 CCOc1cc(ccc1N)N 34a_100025717382_100000210202 [0,1,1,0,0,0|1,0,1]=4 1651 B11R1.182 CCOc1cc(ccc1N)O 271570a_203496583355_100000688918 [0,1,1,0,0,0|1,0,1]=4 1652 B11R1.182 CCOc1cc(ccc1O)C 271570a_203496583355_200010713166 [0,1,1,0,0,0|1,0,1]=4 1653 B11R1.182 CCOc1cc(ccc1O)F 271570a_203496583355_200012340411 [0,1,1,0,0,0|1,0,1]=4 1654 B11R1.182 CCOc1cc(ccc1O)N 271570a_203496583355_200016990551 [0,1,1,0,0,0|1,0,1]=4 1655 B11R1.182 CCSc1cc(ccc1O)Br 62a_100000210202_100012355227 [0,1,1,0,0,0|1,0,1]=4 1656 B11R1.182 CCSc1cc(ccc1O)Br 62a_100012355227_100000210202 [0,1,1,0,0,0|1,0,1]=4 1657 B11R1.182 CCSc1cc(ccc1O)C 62a_100000210202_100000765521 [0,1,1,0,0,0|1,0,1]=4 1658 B11R1.182 CCSc1cc(ccc1O)C 62a_100000765521_100000210202 [0,1,1,0,0,0|1,0,1]=4 1659 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100000210202_100011356953 [0,1,1,0,0,0|1,0,1]=4 1660 B11R1.182 CCSc1cc(ccc1O)Cl 62a_100011356953_100000210202 [0,1,1,0,0,0|1,0,1]=4 1661 B11R1.182 CCSc1cc(ccc1O)F 62a_100000210202_100000211999 [0,1,1,0,0,0|1,0,1]=4 1662 B11R1.182 CCSc1cc(ccc1O)F 62a_100000211999_100000210202 [0,1,1,0,0,0|1,0,1]=4 1663 B11R1.182 CCSc1cc(ccc1O)N 62a_100000210202_100011534360 [0,1,1,0,0,0|1,0,1]=4 1664 B11R1.182 CCSc1cc(ccc1O)N 62a_100011534360_100000210202 [0,1,1,0,0,0|1,0,1]=4 1665 B11R1.182 CCSc1cc(ccc1O)O 62a_100000210202_100009813629 [0,1,1,0,0,0|1,0,1]=4 1666 B11R1.182 CNCc1cc(ccc1O)Br 34a_100000730032_200000210301 [0,1,1,0,0,0|1,0,1]=4 1667 B11R1.182 CNCc1cc(ccc1O)Cl 34a_100000238540_200000210301 [0,1,1,0,0,0|1,0,1]=4 1668 B11R1.182 CNCc1cc(ccc1O)F 34a_100102657272_100010161318 [0,1,1,0,0,0|1,0,1]=4 1669 B11R1.182 CNCc1cc(ccc1O)F 7a_106832991635_100010161318 [0,1,1,0,0,0|1,0,1]=4 1670 B11R1.182 CNCc1cc(ccc1O)O 271570a_203496583355_100011602694 [0,1,1,0,0,0|1,0,1]=4 1671 B11R1.182 COCc1cc(ccc1O)F 34a_100138415774_100010161318 [0,1,1,0,0,0|1,0,1]=4 1672 B11R1.182 CSCc1cc(ccc1O)F 62a_100010161318_200000210301 [0,1,1,0,0,0|1,0,1]=4 1673 B11R1.182 CSCc1cc(ccc1O)F 62a_200000210301_100010161318 [0,1,1,0,0,0|1,0,1]=4 1674 B11R1.182 [13CH3]NCc1cc(ccc1O)Br 34a_100000730032_200025704644 [0,1,1,0,0,0|1,0,1]=4 1675 B11R1.182 [13CH3]NCc1cc(ccc1O)Cl 34a_100000238540_200025704644 [0,1,1,0,0,0|1,0,1]=4 1676 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_100010161318_200025704644 [0,1,1,0,0,0|1,0,1]=4 1677 B11R1.182 [13CH3]SCc1cc(ccc1O)F 62a_200025704644_100010161318 [0,1,1,0,0,0|1,0,1]=4 1678 B11R1.222 CCC(=O)c1ccccc1Br 1458a_100000188424_100000210202 [0,1,1,0,0,0|1,0,1]=4 1679 B11R1.222 CCC(=O)c1ccccc1C 1458a_100000212026_100000210202 [0,1,1,0,0,0|1,0,1]=4 1680 B11R1.222 CCC(=O)c1ccccc1Cl 1458a_100000185844_100000210202 [0,1,1,0,0,0|1,0,1]=4 1681 B11R1.222 CCC(=O)c1ccccc1F 1458a_100000188656_100000210202 [0,1,1,0,0,0|1,0,1]=4 1682 B11R1.222 CCC(=O)c1ccccc1I 1458a_100000187884_100000210202 [0,1,1,0,0,0|1,0,1]=4 1683 B11R1.222 CCC(=O)c1ccccc1O 1458a_100015234032_100000210202 [0,1,1,0,0,0|0,0,1]=3 1684 B11R1.222 CCC(=O)c1ccccc1[O-] 1458a_100009911694_100000210202 [0,1,1,0,0,0|0,0,2]=4 1685 B11R1.222 CCN(C)c1ccccc1O 269982a_100000033821_100000204670 [0,1,1,0,0,0|1,0,1]=4 1686 B11R1.222 CCN(C)c1ccccc1O 269982a_103624766699_200000210301 [0,1,1,0,0,0|1,0,1]=4 1687 B11R1.222 CCN([13CH3])c1ccccc1O 269982a_103624766699_200025704644 [0,1,1,0,0,0|1,0,1]=4 1688 B11R1.222 CNC(=O)c1ccccc1Br 11a_106832991635_100000188424 [0,1,1,0,0,0|2,0,0]=4 1689 B11R1.222 CNC(=O)c1ccccc1Br 1626a_100102657272_100000188424 [0,1,1,0,0,0|2,0,0]=4 1690 B11R1.222 CNC(=O)c1ccccc1Br 240690a_100102657272_100000188424 [0,1,1,0,0,0|2,0,0]=4 1691 B11R1.222 CNC(=O)c1ccccc1Br 527a_100102657272_100000188424 [0,1,1,0,0,0|2,0,0]=4 1692 B11R1.222 CNC(=O)c1ccccc1C 11a_106832991635_100000212026 [0,1,1,0,0,0|2,0,0]=4 1693 B11R1.222 CNC(=O)c1ccccc1C 1626a_100102657272_100000212026 [0,1,1,0,0,0|2,0,0]=4 1694 B11R1.222 CNC(=O)c1ccccc1C 240690a_100102657272_100000212026 [0,1,1,0,0,0|2,0,0]=4 1695 B11R1.222 CNC(=O)c1ccccc1C 527a_100102657272_100000212026 [0,1,1,0,0,0|2,0,0]=4 1696 B11R1.222 CNC(=O)c1ccccc1Cl 11a_106832991635_100000185844 [0,1,1,0,0,0|2,0,0]=4 1697 B11R1.222 CNC(=O)c1ccccc1Cl 1626a_100102657272_100000185844 [0,1,1,0,0,0|2,0,0]=4 1698 B11R1.222 CNC(=O)c1ccccc1Cl 240690a_100102657272_100000185844 [0,1,1,0,0,0|2,0,0]=4 1699 B11R1.222 CNC(=O)c1ccccc1Cl 527a_100102657272_100000185844 [0,1,1,0,0,0|2,0,0]=4 1700 B11R1.222 CNC(=O)c1ccccc1F 11a_106832991635_100000188656 [0,1,1,0,0,0|2,0,0]=4 1701 B11R1.222 CNC(=O)c1ccccc1F 1626a_100102657272_100000188656 [0,1,1,0,0,0|2,0,0]=4 1702 B11R1.222 CNC(=O)c1ccccc1F 240690a_100102657272_100000188656 [0,1,1,0,0,0|2,0,0]=4 1703 B11R1.222 CNC(=O)c1ccccc1F 527a_100102657272_100000188656 [0,1,1,0,0,0|2,0,0]=4 1704 B11R1.222 CNC(=O)c1ccccc1I 11a_106832991635_100000187884 [0,1,1,0,0,0|2,0,0]=4 1705 B11R1.222 CNC(=O)c1ccccc1I 1626a_100102657272_100000187884 [0,1,1,0,0,0|2,0,0]=4 1706 B11R1.222 CNC(=O)c1ccccc1I 240690a_100102657272_100000187884 [0,1,1,0,0,0|2,0,0]=4 1707 B11R1.222 CNC(=O)c1ccccc1I 527a_100102657272_100000187884 [0,1,1,0,0,0|2,0,0]=4 1708 B11R1.222 CNC(=O)c1ccccc1O 240690a_100102657272_100015234032 [0,1,1,0,0,0|1,0,0]=3 1709 B11R1.222 CNC(=O)c1ccccc1O 271570a_203496583355_100000155073 [0,1,1,0,0,0|1,0,0]=3 1710 B11R1.222 CNC(=O)c1ccccc1[O-] 1626a_100102657272_100009911694 [0,1,1,0,0,0|1,0,1]=4 1711 B11R1.222 CNC(=O)c1ccccc1[O-] 240690a_100102657272_100009911694 [0,1,1,0,0,0|1,0,1]=4 1712 B11R1.222 CNC(=O)c1ccccc1[O-] 527a_100102657272_100009911694 [0,1,1,0,0,0|1,0,1]=4 1713 B11R1.222 CNC(=O)c1cccnc1O 271570a_203496583355_100000159833 [0,1,1,0,0,0|2,0,0]=4 1714 B11R1.222 CNC(C)c1ccccc1O 271570a_203496583355_100000692418 [0,1,1,0,0,0|1,0,1]=4 1715 B11R1.222 CN[C@H](C)c1ccccc1O 2230a_100025703389_200000210301 [0,1,1,0,0,0|1,0,1]=4 1716 B11R1.222 COC(=O)c1ccccc1O 271570a_203496583355_100000148710 [0,1,1,0,0,0|1,0,0]=3 1717 B11R1.222 COC(=O)c1cccnc1O 271570a_203496583355_100000150852 [0,1,1,0,0,0|2,0,0]=4 1718 B11R1.222 COC(=O)c1ccncc1O 271570a_203496583355_100010008606 [0,1,1,0,0,0|2,0,0]=4 1719 B11R1.222 COC(=O)c1cnccc1O 271570a_203496583355_100020629055 [0,1,1,0,0,0|2,0,0]=4 1720 B11R1.222 COC(=O)c1ncccc1O 271570a_203496583355_100011935214 [0,1,1,0,0,0|2,0,0]=4 1721 B11R1.222 C[C@@H](N[13CH3])c1ccccc1O 2230a_100025703389_200025704644 [0,1,1,0,0,0|1,0,1]=4 1722 B11R1.222 NNC(=O)c1ccccc1O 271570a_203496583355_100000190081 [0,1,1,0,0,0|2,0,0]=4 1723 B11R1.222 O=C(CF)c1ccccc1O 1458a_100015234032_100015361967 [0,1,1,0,0,0|1,0,1]=4 1724 B11R1.605 C=C=Cc1c(cccc1Br)O 271570a_100015277604_100010187912 [0,1,1,0,0,0|0,0,2]=4 1725 B11R1.605 C=C=Cc1c(cccc1Cl)O 271570a_100015277604_100000050174 [0,1,1,0,0,0|0,0,2]=4 1726 B11R1.605 C=C=Cc1c(cccc1F)O 271570a_100015277604_100009820682 [0,1,1,0,0,0|0,0,2]=4 1727 B11R1.605 C=C=Cc1c(cccc1O)C 271570a_100015277604_100000686692 [0,1,1,0,0,0|0,0,2]=4 1728 B11R1.605 C=C=Cc1c(cccc1O)N 271570a_100015277604_100012183704 [0,1,1,0,0,0|0,0,2]=4 1729 B11R1.605 C=C=Cc1c(cccc1O)O 271570a_100015277604_100010205330 [0,1,1,0,0,0|0,0,2]=4 1730 B11R1.605 CC=Cc1c(ccc[n+]1[O-])C 271570a_100016259895_100116209805 [0,1,1,0,0,0|1,0,1]=4 1731 B11R1.605 CC=Cc1c(cccc1Br)Br 271570a_100016259895_100009994525 [0,1,1,0,0,0|1,0,0]=3 1732 B11R1.605 CC=Cc1c(cccc1Br)Cl 271570a_100016259895_100010214488 [0,1,1,0,0,0|1,0,0]=3 1733 B11R1.605 CC=Cc1c(cccc1Br)F 271570a_100016259895_100011219512 [0,1,1,0,0,0|1,0,0]=3 1734 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [0,1,1,0,0,0|1,0,0]=3 1735 B11R1.605 CC=Cc1c(cccc1Br)O 271570a_100016259895_100010187912 [0,1,1,0,0,0|0,0,0]=2 1736 B11R1.605 CC=Cc1c(cccc1C)C 271570a_100016259895_100000033847 [0,1,1,0,0,0|1,0,0]=3 1737 B11R1.605 CC=Cc1c(cccc1Cl)C 271570a_100016259895_100000043165 [0,1,1,0,0,0|1,0,0]=3 1738 B11R1.605 CC=Cc1c(cccc1Cl)Cl 271570a_100016259895_100000034237 [0,1,1,0,0,0|1,0,0]=3 1739 B11R1.605 CC=Cc1c(cccc1Cl)F 271570a_100016259895_100000050007 [0,1,1,0,0,0|1,0,0]=3 1740 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [0,1,1,0,0,0|1,0,0]=3 1741 B11R1.605 CC=Cc1c(cccc1Cl)O 271570a_100016259895_100000050174 [0,1,1,0,0,0|0,0,0]=2 1742 B11R1.605 CC=Cc1c(cccc1F)C 271570a_100016259895_100012349962 [0,1,1,0,0,0|1,0,0]=3 1743 B11R1.605 CC=Cc1c(cccc1F)F 271570a_100016259895_100000693133 [0,1,1,0,0,0|1,0,0]=3 1744 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [0,1,1,0,0,0|1,0,0]=3 1745 B11R1.605 CC=Cc1c(cccc1F)O 271570a_100016259895_100009820682 [0,1,1,0,0,0|0,0,0]=2 1746 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,1,1,0,0,0|1,0,0]=3 1747 B11R1.605 CC=Cc1c(cccc1O)C 271570a_100016259895_100000686692 [0,1,1,0,0,0|0,0,0]=2 1748 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,1,1,0,0,0|0,0,0]=2 1749 B11R1.605 CC=Cc1c(cccc1O)O 271570a_100016259895_100010205330 [0,1,1,0,0,0|0,0,0]=2 1750 B11R1.605 CC=Cc1c(ccnc1C)C 271570a_100016259895_100012000501 [0,1,1,0,0,0|2,0,0]=4 1751 B11R1.605 CC=Cc1c(ccnc1C)N 271570a_100016259895_100010243816 [0,1,1,0,0,0|2,0,0]=4 1752 B11R1.605 CC=Cc1c(ccnc1F)C 271570a_100016259895_100009818256 [0,1,1,0,0,0|2,0,0]=4 1753 B11R1.605 CC=Cc1c(ccnc1F)F 271570a_100016259895_100009874084 [0,1,1,0,0,0|2,0,0]=4 1754 B11R1.605 CC=Cc1c(ccnc1F)N 271570a_100016259895_100010381272 [0,1,1,0,0,0|2,0,0]=4 1755 B11R1.605 CC=Cc1c(ccnc1N)C 271570a_100016259895_100011998619 [0,1,1,0,0,0|2,0,0]=4 1756 B11R1.605 CC=Cc1c(ccnc1N)Cl 271570a_100016259895_100010199028 [0,1,1,0,0,0|2,0,0]=4 1757 B11R1.605 CC=Cc1c(ccnc1O)C 271570a_100016259895_100012000493 [0,1,1,0,0,0|1,0,0]=3 1758 B11R1.605 CC=Cc1c(ccnc1O)O 271570a_100016259895_200009817435 [0,1,1,0,0,0|1,0,0]=3 1759 B11R1.605 CC=Cc1c(cn[nH]c1=O)O 271570a_100016259895_100000116976 [0,1,1,0,0,0|2,0,0]=4 1760 B11R1.605 CC=Cc1c(cncc1Br)Br 271570a_100016259895_100010172828 [0,1,1,0,0,0|2,0,0]=4 1761 B11R1.605 CC=Cc1c(cncc1C)C 271570a_100016259895_100009817138 [0,1,1,0,0,0|2,0,0]=4 1762 B11R1.605 CC=Cc1c(cncc1Cl)Cl 271570a_100016259895_100000036193 [0,1,1,0,0,0|2,0,0]=4 1763 B11R1.605 CC=Cc1c(cncc1F)F 271570a_100016259895_100000760538 [0,1,1,0,0,0|2,0,0]=4 1764 B11R1.605 CCNc1c(cccc1Br)O 34a_100011934926_100000210202 [0,1,1,0,0,0|1,0,1]=4 1765 B11R1.605 CCNc1c(cccc1Cl)O 34a_100012022510_100000210202 [0,1,1,0,0,0|1,0,1]=4 1766 B11R1.605 CCNc1c(cccc1F)O 34a_100020591140_100000210202 [0,1,1,0,0,0|1,0,1]=4 1767 B11R1.605 CCNc1c(cccc1O)C 34a_100000743429_100000210202 [0,1,1,0,0,0|1,0,1]=4 1768 B11R1.605 CCOc1c(cccc1Br)Br 34a_100000736428_100000210202 [0,1,1,0,0,0|1,0,1]=4 1769 B11R1.605 CCOc1c(cccc1Br)Br 7a_100000736428_100000210202 [0,1,1,0,0,0|1,0,1]=4 1770 B11R1.605 CCOc1c(cccc1Br)C 34a_100009817157_100000210202 [0,1,1,0,0,0|0,0,2]=4 1771 B11R1.605 CCOc1c(cccc1Br)C 7a_100009817157_100000210202 [0,1,1,0,0,0|0,0,2]=4 1772 B11R1.605 CCOc1c(cccc1Br)Cl 34a_100010214474_100000210202 [0,1,1,0,0,0|1,0,1]=4 1773 B11R1.605 CCOc1c(cccc1Br)Cl 7a_100010214474_100000210202 [0,1,1,0,0,0|1,0,1]=4 1774 B11R1.605 CCOc1c(cccc1Br)F 34a_100009813666_100000210202 [0,1,1,0,0,0|1,0,1]=4 1775 B11R1.605 CCOc1c(cccc1Br)F 7a_100009813666_100000210202 [0,1,1,0,0,0|1,0,1]=4 1776 B11R1.605 CCOc1c(cccc1Br)N 34a_100011934915_100000210202 [0,1,1,0,0,0|1,0,1]=4 1777 B11R1.605 CCOc1c(cccc1C)C 34a_100000210341_100000210202 [0,1,1,0,0,0|0,0,2]=4 1778 B11R1.605 CCOc1c(cccc1C)C 7a_100000210341_100000210202 [0,1,1,0,0,0|0,0,2]=4 1779 B11R1.605 CCOc1c(cccc1Cl)C 34a_100000033731_100000210202 [0,1,1,0,0,0|0,0,2]=4 1780 B11R1.605 CCOc1c(cccc1Cl)C 7a_100000033731_100000210202 [0,1,1,0,0,0|0,0,2]=4 1781 B11R1.605 CCOc1c(cccc1Cl)Cl 34a_100000211709_100000210202 [0,1,1,0,0,0|1,0,1]=4 1782 B11R1.605 CCOc1c(cccc1Cl)Cl 7a_100000211709_100000210202 [0,1,1,0,0,0|1,0,1]=4 1783 B11R1.605 CCOc1c(cccc1Cl)F 34a_100000694953_100000210202 [0,1,1,0,0,0|1,0,1]=4 1784 B11R1.605 CCOc1c(cccc1Cl)F 7a_100000694953_100000210202 [0,1,1,0,0,0|1,0,1]=4 1785 B11R1.605 CCOc1c(cccc1Cl)N 34a_100000754742_100000210202 [0,1,1,0,0,0|1,0,1]=4 1786 B11R1.605 CCOc1c(cccc1F)C 34a_100011659162_100000210202 [0,1,1,0,0,0|0,0,2]=4 1787 B11R1.605 CCOc1c(cccc1F)C 7a_100011659162_100000210202 [0,1,1,0,0,0|0,0,2]=4 1788 B11R1.605 CCOc1c(cccc1F)F 34a_100000230165_100000210202 [0,1,1,0,0,0|1,0,1]=4 1789 B11R1.605 CCOc1c(cccc1F)F 7a_100000230165_100000210202 [0,1,1,0,0,0|1,0,1]=4 1790 B11R1.605 CCOc1c(cccc1F)N 34a_100011934987_100000210202 [0,1,1,0,0,0|1,0,1]=4 1791 B11R1.605 CCOc1c(cccc1F)O 271570a_203496583355_100010232518 [0,1,1,0,0,0|1,0,1]=4 1792 B11R1.605 CCOc1c(cccc1I)Br 34a_100010084509_100000210202 [0,1,1,0,0,0|1,0,1]=4 1793 B11R1.605 CCOc1c(cccc1I)Br 7a_100010084509_100000210202 [0,1,1,0,0,0|1,0,1]=4 1794 B11R1.605 CCOc1c(cccc1I)Cl 34a_100010202889_100000210202 [0,1,1,0,0,0|1,0,1]=4 1795 B11R1.605 CCOc1c(cccc1I)Cl 7a_100010202889_100000210202 [0,1,1,0,0,0|1,0,1]=4 1796 B11R1.605 CCOc1c(cccc1I)F 34a_100010186298_100000210202 [0,1,1,0,0,0|1,0,1]=4 1797 B11R1.605 CCOc1c(cccc1I)F 7a_100010186298_100000210202 [0,1,1,0,0,0|1,0,1]=4 1798 B11R1.605 CCOc1c(cccc1I)N 34a_100010084371_100000210202 [0,1,1,0,0,0|1,0,1]=4 1799 B11R1.605 CCOc1c(cccc1N)C 34a_100000756359_100000210202 [0,1,1,0,0,0|0,0,2]=4 1800 B11R1.605 CCOc1c(cccc1N)C 7a_100000756359_100000210202 [0,1,1,0,0,0|0,0,2]=4 1801 B11R1.605 CCOc1c(cccc1N)N 34a_200016994477_100000210202 [0,1,1,0,0,0|1,0,1]=4 1802 B11R1.605 CCSc1c(cccc1Br)O 62a_100000210202_100010187912 [0,1,1,0,0,0|1,0,1]=4 1803 B11R1.605 CCSc1c(cccc1Br)O 62a_100010187912_100000210202 [0,1,1,0,0,0|1,0,1]=4 1804 B11R1.605 CCSc1c(cccc1Cl)O 62a_100000210202_100000050174 [0,1,1,0,0,0|1,0,1]=4 1805 B11R1.605 CCSc1c(cccc1F)O 62a_100000210202_100009820682 [0,1,1,0,0,0|1,0,1]=4 1806 B11R1.605 CCSc1c(cccc1F)O 62a_100009820682_100000210202 [0,1,1,0,0,0|1,0,1]=4 1807 B11R1.605 CCSc1c(cccc1O)C 62a_100000210202_100000686692 [0,1,1,0,0,0|1,0,1]=4 1808 B11R1.605 CCSc1c(cccc1O)C 62a_100000686692_100000210202 [0,1,1,0,0,0|1,0,1]=4 1809 B11R1.605 CCSc1c(cccc1O)N 62a_100000210202_100012183704 [0,1,1,0,0,0|1,0,1]=4 1810 B11R1.605 CCSc1c(cccc1O)N 62a_100012183704_100000210202 [0,1,1,0,0,0|1,0,1]=4 1811 B11R1.605 CCSc1c(cccc1O)O 62a_100000210202_100010205330 [0,1,1,0,0,0|1,0,1]=4 1812 B11R1.605 CNCc1c(cccc1F)O 271570a_203496583355_106744473292 [0,1,1,0,0,0|1,0,1]=4 1813 B11R1.27 C=CCNCc1ccc(o1)C 270004a_100020586998_100000183696 [0,1,1,0,0,0|0,0,2]=4 1814 B11R1.27 C=CCNCc1ccc(o1)C 34a_100011194323_100015514636 [0,1,1,0,0,0|0,0,2]=4 1815 B11R1.27 C=CCOCc1ccc(o1)C 34a_100011232665_100015514636 [0,1,1,0,0,0|0,0,2]=4 1816 B11R1.27 C=CCOCc1ccc(o1)C 7a_100011232665_100015514636 [0,1,1,0,0,0|0,0,2]=4 1817 B11R1.39 C=CC(=O)Cc1cc(on1)C 1458a_100000185746_100000199038 [0,1,1,0,0,0|1,0,1]=4 1818 B11R1.75 CC(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200000210301 [0,1,1,0,0,0|1,0,1]=4 1819 B11R1.75 CC(=O)C=Cc1ccc(o1)C 1458a_100000183563_200000210301 [0,1,1,0,0,0|0,0,1]=3 1820 B11R1.75 CC(=O)C=Cc1ccc(o1)I 1458a_100000679848_200000210301 [0,1,1,0,0,0|1,0,1]=4 1821 B11R1.75 CC(=O)C=Cc1ccc(s1)C 1458a_100102558089_200000210301 [0,1,1,0,0,0|0,1,1]=4 1822 B11R1.75 Cc1ccc(o1)C=CC(=O)[13CH3] 1458a_100000183563_200025704644 [0,1,1,0,0,0|0,0,1]=3 1823 B11R1.75 Cc1ccc(s1)C=CC(=O)[13CH3] 1458a_100102558089_200025704644 [0,1,1,0,0,0|0,1,1]=4 1824 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)Br 1458a_100000182240_200025704644 [0,1,1,0,0,0|1,0,1]=4 1825 B11R1.75 [13CH3]C(=O)C=Cc1ccc(o1)I 1458a_100000679848_200025704644 [0,1,1,0,0,0|1,0,1]=4 1826 B11R1.214 C=CCSc1ccc(o1)CN 62a_100000210623_100000708654 [0,1,1,0,0,0|1,0,1]=4 1827 B11R1.214 C=CCSc1ccc(o1)CO 62a_100000210623_100000246276 [0,1,1,0,0,0|1,0,1]=4 1828 B11R1.214 C=CCSc1ccc(o1)CO 62a_100000246276_100000210623 [0,1,1,0,0,0|1,0,1]=4 1829 B11R1.20 CC(=Cc1cc[n+](cc1)[O-])C 271570a_100102525489_100000039755 [0,1,1,0,0,0|2,0,0]=4 1830 B11R1.20 CC(=Cc1ccc(=O)[nH]c1)C 271570a_100102525489_100000212171 [0,1,1,0,0,0|2,0,0]=4 1831 B11R1.20 CC(=Cc1ccc(cc1)Br)C 271570a_100102525489_100000752885 [0,1,1,0,0,0|1,0,0]=3 1832 B11R1.20 CC(=Cc1ccc(cc1)C)C 271570a_100102525489_100000186775 [0,1,1,0,0,0|1,0,0]=3 1833 B11R1.20 CC(=Cc1ccc(cc1)Cl)C 271570a_100102525489_100000755918 [0,1,1,0,0,0|1,0,0]=3 1834 B11R1.20 CC(=Cc1ccc(cc1)F)C 271570a_100102525489_100000211213 [0,1,1,0,0,0|1,0,0]=3 1835 B11R1.20 CC(=Cc1ccc(cc1)N)C 271570a_100102525489_100000185761 [0,1,1,0,0,0|1,0,0]=3 1836 B11R1.20 CC(=Cc1ccc(cc1)O)C 271570a_100102525489_100000185759 [0,1,1,0,0,0|1,0,0]=3 1837 B11R1.20 CC(=Cc1ccc(cn1)Br)C 271570a_100102525489_100000686858 [0,1,1,0,0,0|2,0,0]=4 1838 B11R1.20 CC(=Cc1ccc(cn1)C)C 271570a_100102525489_100000754016 [0,1,1,0,0,0|2,0,0]=4 1839 B11R1.20 CC(=Cc1ccc(cn1)Cl)C 271570a_100102525489_100011356976 [0,1,1,0,0,0|2,0,0]=4 1840 B11R1.20 CC(=Cc1ccc(cn1)F)C 271570a_100102525489_100000744514 [0,1,1,0,0,0|2,0,0]=4 1841 B11R1.20 CC(=Cc1ccc(cn1)N)C 271570a_100102525489_100000744251 [0,1,1,0,0,0|2,0,0]=4 1842 B11R1.20 CC(=Cc1ccc(cn1)O)C 271570a_100102525489_100000685995 [0,1,1,0,0,0|2,0,0]=4 1843 B11R1.20 CC(=Cc1ccc(nc1)Br)C 271570a_100102525489_100009814638 [0,1,1,0,0,0|2,0,0]=4 1844 B11R1.20 CC(=Cc1ccc(nc1)C)C 271570a_100102525489_100000751577 [0,1,1,0,0,0|2,0,0]=4 1845 B11R1.20 CC(=Cc1ccc(nc1)Cl)C 271570a_100102525489_100000034144 [0,1,1,0,0,0|2,0,0]=4 1846 B11R1.20 CC(=Cc1ccc(nc1)F)C 271570a_100102525489_100000748661 [0,1,1,0,0,0|2,0,0]=4 1847 B11R1.20 CC(=Cc1ccc(nc1)N)C 271570a_100102525489_100000187370 [0,1,1,0,0,0|2,0,0]=4 1848 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000070787_100000189115 [0,1,1,0,0,0|0,0,2]=4 1849 B11R1.20 CC(=O)Cc1ccc(cc1)Br 1458a_100000198978_200000210301 [0,1,1,0,0,0|0,0,2]=4 1850 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000070787_100000210814 [0,1,1,0,0,0|0,0,2]=4 1851 B11R1.20 CC(=O)Cc1ccc(cc1)C 1458a_100000212244_200000210301 [0,1,1,0,0,0|0,0,2]=4 1852 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000070787_100000694040 [0,1,1,0,0,0|0,0,2]=4 1853 B11R1.20 CC(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200000210301 [0,1,1,0,0,0|0,0,2]=4 1854 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000070787_100000198546 [0,1,1,0,0,0|0,0,2]=4 1855 B11R1.20 CC(=O)Cc1ccc(cc1)F 1458a_100000210951_200000210301 [0,1,1,0,0,0|0,0,2]=4 1856 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000070787_100000189116 [0,1,1,0,0,0|0,0,2]=4 1857 B11R1.20 CC(=O)Cc1ccc(cc1)I 1458a_100000688869_200000210301 [0,1,1,0,0,0|0,0,2]=4 1858 B11R1.20 CC(=O)Cc1ccc(cc1)O 1458a_100000198540_200000210301 [0,1,1,0,0,0|0,0,2]=4 1859 B11R1.20 CC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000691760 [0,1,1,0,0,0|0,0,2]=4 1860 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,1,1,0,0,0|1,0,1]=4 1861 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,1,1,0,0,0|1,0,1]=4 1862 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,1,1,0,0,0|1,0,1]=4 1863 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,1,1,0,0,0|1,0,1]=4 1864 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,1,1,0,0,0|1,0,1]=4 1865 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,1,1,0,0,0|1,0,1]=4 1866 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,1,1,0,0,0|1,0,1]=4 1867 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,1,1,0,0,0|1,0,1]=4 1868 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,1,1,0,0,0|1,0,1]=4 1869 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,1,1,0,0,0|1,0,1]=4 1870 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,1,1,0,0,0|1,0,1]=4 1871 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,1,1,0,0,0|1,0,1]=4 1872 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,1,1,0,0,0|1,0,1]=4 1873 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,1,1,0,0,0|1,0,1]=4 1874 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,1,1,0,0,0|1,0,1]=4 1875 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,1,1,0,0,0|1,0,1]=4 1876 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,1,1,0,0,0|1,0,1]=4 1877 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,1,1,0,0,0|1,0,1]=4 1878 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,1,1,0,0,0|1,0,1]=4 1879 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,1,1,0,0,0|1,0,1]=4 1880 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,1,1,0,0,0|1,0,1]=4 1881 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,1,1,0,0,0|1,0,1]=4 1882 B11R1.20 CC(=O)Oc1ccc(cc1)O 271570a_203496583355_100000002173 [0,1,1,0,0,0|1,0,0]=3 1883 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,1,1,0,0,0|1,0,1]=4 1884 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,1,1,0,0,0|1,0,0]=3 1885 B11R1.20 CC(C)Oc1ccc(cc1)Br 34a_100000185759_100000210206 [0,1,1,0,0,0|0,0,2]=4 1886 B11R1.20 CC(C)Oc1ccc(cc1)Br 7a_100000185759_100000210206 [0,1,1,0,0,0|0,0,2]=4 1887 B11R1.20 CC(C)Oc1ccc(cc1)Cl 34a_100000210216_100000210206 [0,1,1,0,0,0|0,0,2]=4 1888 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7a_100000210216_100000210206 [0,1,1,0,0,0|0,0,2]=4 1889 B11R1.20 CC(C)Oc1ccc(cc1)F 34a_100000210339_100000210206 [0,1,1,0,0,0|0,0,2]=4 1890 B11R1.20 CC(C)Oc1ccc(cc1)I 34a_100000212066_100000210206 [0,1,1,0,0,0|0,0,2]=4 1891 B11R1.20 CC(C)Oc1ccc(cc1)I 7a_100000212066_100000210206 [0,1,1,0,0,0|0,0,2]=4 1892 B11R1.20 CC(C)Oc1ccc(cc1)N 34a_100000185829_100000210206 [0,1,1,0,0,0|0,0,2]=4 1893 B11R1.20 CC(C)Oc1ccc(cc1)O 271570a_203496583355_100000169947 [0,1,1,0,0,0|0,0,2]=4 1894 B11R1.20 Cc1ccc(cc1)CC(=O)[13CH3] 1458a_100000212244_200025704644 [0,1,1,0,0,0|0,0,2]=4 1895 B11R1.20 Cc1ccc(cc1)OC(C)C 34a_100000210336_100000210206 [0,1,1,0,0,0|0,0,2]=4 1896 B11R1.20 Cc1ccc(cc1)OC(C)C 7a_100000210336_100000210206 [0,1,1,0,0,0|0,0,2]=4 1897 B11R1.20 Oc1ccc(cc1)C=C(Br)Br 271570a_203496583355_200013992848 [0,1,1,0,0,0|2,0,0]=4 1898 B11R1.20 Oc1ccc(cc1)C=C(F)F 271570a_203496583355_200009816947 [0,1,1,0,0,0|2,0,0]=4 1899 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Br 1458a_100000198978_200025704644 [0,1,1,0,0,0|0,0,2]=4 1900 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)Cl 1458a_100000211027_200025704644 [0,1,1,0,0,0|0,0,2]=4 1901 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)F 1458a_100000210951_200025704644 [0,1,1,0,0,0|0,0,2]=4 1902 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)I 1458a_100000688869_200025704644 [0,1,1,0,0,0|0,0,2]=4 1903 B11R1.20 [13CH3]C(=O)Cc1ccc(cc1)O 1458a_100000198540_200025704644 [0,1,1,0,0,0|0,0,2]=4 1904 B11R1.36 C=C(C(=O)C)c1ccccc1 1458a_100000065200_200000210301 [0,1,1,0,0,0|0,0,1]=3 1905 B11R1.36 C=C(C(=O)[13CH3])c1ccccc1 1458a_100000065200_200025704644 [0,1,1,0,0,0|0,0,1]=3 1906 B11R1.36 CC(=C(C)c1ccccc1)C 271570a_200000049429_100000210277 [0,1,1,0,0,0|1,0,0]=3 1907 B11R1.36 CC(=C(C)c1ccccn1)C 271570a_200000049429_100011216584 [0,1,1,0,0,0|2,0,0]=4 1908 B11R1.36 CC(=C(C)c1cccnc1)C 271570a_200000049429_100000752921 [0,1,1,0,0,0|2,0,0]=4 1909 B11R1.36 CC(=C(C)c1ccncc1)C 271570a_200000049429_100000035832 [0,1,1,0,0,0|2,0,0]=4 1910 B11R1.36 CC(=O)C(C)c1ccccc1 1458a_100000070787_100000230085 [0,1,1,0,0,0|0,0,2]=4 1911 B11R1.36 CC(=O)C(F)c1ccccc1 1458a_100000698975_200000210301 [0,1,1,0,0,0|0,0,2]=4 1912 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [0,1,1,0,0,0|1,0,1]=4 1913 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [0,1,1,0,0,0|1,0,1]=4 1914 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [0,1,1,0,0,0|1,0,1]=4 1915 B11R1.36 CC(=O)[C@@H](C)c1ccccc1 1458a_100000751047_200000210301 [0,1,1,0,0,0|0,0,2]=4 1916 B11R1.36 CC(=O)[C@H](O)c1ccccc1 1458a_100000684486_200000210301 [0,1,1,0,0,0|0,0,2]=4 1917 B11R1.36 CC(C)C(=O)c1ccccc1 1458a_100000185807_100000210206 [0,1,1,0,0,0|1,0,1]=4 1918 B11R1.36 CN(C)C(=O)c1ccccc1 11a_100102631434_100000185807 [0,1,1,0,0,0|2,0,0]=4 1919 B11R1.36 CN(C)C(=O)c1ccccc1 1626a_100102631434_100000185807 [0,1,1,0,0,0|2,0,0]=4 1920 B11R1.36 CN(C)C(=O)c1ccccc1 240690a_100102631434_100000185807 [0,1,1,0,0,0|2,0,0]=4 1921 B11R1.36 CN(C)C(=O)c1ccccc1 527a_100102631434_100000185807 [0,1,1,0,0,0|2,0,0]=4 1922 B11R1.36 C[C@H](C(=O)[13CH3])c1ccccc1 1458a_100000751047_200025704644 [0,1,1,0,0,0|0,0,2]=4 1923 B11R1.36 [13CH3]C(=O)C(F)c1ccccc1 1458a_100000698975_200025704644 [0,1,1,0,0,0|0,0,2]=4 1924 B11R1.36 [13CH3]C(=O)[C@H](O)c1ccccc1 1458a_100000684486_200025704644 [0,1,1,0,0,0|0,0,2]=4 1925 B11R1.40 C#CC(C)Oc1ccccc1 34a_100000210340_200000035995 [0,1,1,0,0,0|0,0,2]=4 1926 B11R1.40 C=CC(=O)Cc1ccccc1 1458a_100000185746_100015291786 [0,1,1,0,0,0|2,0,0]=4 1927 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,1,1,0,0,0|2,0,0]=4 1928 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,1,1,0,0,0|2,0,0]=4 1929 B11R1.40 C=CC(C)Sc1ccccc1 62a_100011215867_100000041952 [0,1,1,0,0,0|0,1,1]=4 1930 B11R1.40 CC(C#N)Oc1ccccc1 7a_100000210340_100000703298 [0,1,1,0,0,0|0,0,2]=4 1931 B11R1.40 CC(CO)Nc1ccccc1 34a_100000106764_100012180447 [0,1,1,0,0,0|1,0,1]=4 1932 B11R1.40 CC(CO)Oc1ccccc1 34a_100000210340_100012180447 [0,1,1,0,0,0|0,0,2]=4 1933 B11R1.40 CC(CO)Oc1ccccc1 7a_100000210340_100012180447 [0,1,1,0,0,0|0,0,2]=4 1934 B11R1.40 CC(CO)Sc1ccccc1 62a_100012180447_100000041952 [0,1,1,0,0,0|1,0,1]=4 1935 B11R1.40 CC(Cc1ccccc1)O[13CH3] 34a_100000748627_200025704644 [0,1,1,0,0,0|0,0,2]=4 1936 B11R1.40 CC(Cc1ccccc1)O[13CH3] 7a_100000748627_200025704644 [0,1,1,0,0,0|0,0,2]=4 1937 B11R1.40 CCC(=O)Cc1ccccc1 1458a_100000210414_100015291786 [0,1,1,0,0,0|0,0,2]=4 1938 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [0,1,1,0,0,0|1,0,1]=4 1939 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [0,1,1,0,0,0|1,0,1]=4 1940 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [0,1,1,0,0,0|1,0,1]=4 1941 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [0,1,1,0,0,0|1,0,1]=4 1942 B11R1.40 CCC(C)Oc1ccccc1 34a_100000210340_100011215416 [0,1,1,0,0,0|0,0,2]=4 1943 B11R1.40 CCC(C)Oc1ccccc1 7a_100000210340_100000758301 [0,1,1,0,0,0|0,0,2]=4 1944 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [0,1,1,0,0,0|1,0,1]=4 1945 B11R1.40 COC(C)Cc1ccccc1 34a_100000748627_200000210301 [0,1,1,0,0,0|0,0,2]=4 1946 B11R1.40 COC(C)Cc1ccccc1 34a_100138415774_200011218536 [0,1,1,0,0,0|0,0,2]=4 1947 B11R1.40 COC(C)Cc1ccccc1 7a_100000748627_200000210301 [0,1,1,0,0,0|0,0,2]=4 1948 B11R1.40 COC(C)Sc1ccccc1 62a_100000719477_100009879195 [0,1,1,0,0,0|1,0,1]=4 1949 B11R1.40 COC(C)Sc1ccccc1 62a_100009879195_100000041952 [0,1,1,0,0,0|1,0,1]=4 1950 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100000719477_100016084084 [0,1,1,0,0,0|1,0,1]=4 1951 B11R1.40 C[C@H](CO)Sc1ccccc1 62a_100016084084_100000041952 [0,1,1,0,0,0|1,0,1]=4 1952 B11R1.40 O=C(CO)Cc1ccccc1 1458a_100000210174_100015291786 [0,1,1,0,0,0|0,0,2]=4 1953 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [0,1,1,0,0,0|1,0,1]=4 1954 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [0,1,1,0,0,0|1,0,1]=4 1955 B11R1.157 CC(=Cc1cc(ccn1)C)C 271570a_100102525489_100000750283 [0,1,1,0,0,0|2,0,0]=4 1956 B11R1.157 CC(=Cc1cc(ccn1)Cl)C 271570a_100102525489_100010167805 [0,1,1,0,0,0|2,0,0]=4 1957 B11R1.157 CC(=Cc1cc(ccn1)F)C 271570a_100102525489_100009817058 [0,1,1,0,0,0|2,0,0]=4 1958 B11R1.157 CC(=Cc1cc(ccn1)N)C 271570a_100102525489_100009814236 [0,1,1,0,0,0|2,0,0]=4 1959 B11R1.157 CC(=Cc1cc(ccn1)O)C 271570a_100102525489_100000762945 [0,1,1,0,0,0|2,0,0]=4 1960 B11R1.157 CC(=Cc1cc[nH]c(=O)c1)C 271570a_100102525489_100009816521 [0,1,1,0,0,0|2,0,0]=4 1961 B11R1.157 CC(=Cc1ccc[n+](c1)C)C 271570a_100102525489_100009996589 [0,1,1,0,0,0|2,0,0]=4 1962 B11R1.157 CC(=Cc1ccc[n+](c1)[O-])C 271570a_100102525489_100009815978 [0,1,1,0,0,0|2,0,0]=4 1963 B11R1.157 CC(=Cc1cccc(=O)[nH]1)C 271570a_100102525489_100000761760 [0,1,1,0,0,0|2,0,0]=4 1964 B11R1.157 CC(=Cc1cccc(c1)Br)C 271570a_100102525489_100000691529 [0,1,1,0,0,0|1,0,0]=3 1965 B11R1.157 CC(=Cc1cccc(c1)C)C 271570a_100102525489_100011215228 [0,1,1,0,0,0|1,0,0]=3 1966 B11R1.157 CC(=Cc1cccc(c1)Cl)C 271570a_100102525489_100000699651 [0,1,1,0,0,0|1,0,0]=3 1967 B11R1.157 CC(=Cc1cccc(c1)F)C 271570a_100102525489_100000685547 [0,1,1,0,0,0|1,0,0]=3 1968 B11R1.157 CC(=Cc1cccc(c1)N)C 271570a_100102525489_100000210019 [0,1,1,0,0,0|1,0,0]=3 1969 B11R1.157 CC(=Cc1cccc(c1)O)C 271570a_100102525489_100000211634 [0,1,1,0,0,0|1,0,0]=3 1970 B11R1.157 CC(=Cc1cccc(c1)[S])C 271570a_100102525489_114929384022 [0,1,1,0,0,0|1,0,0]=3 1971 B11R1.157 CC(=Cc1cccc(n1)Br)C 271570a_100102525489_100000684672 [0,1,1,0,0,0|2,0,0]=4 1972 B11R1.157 CC(=Cc1cccc(n1)C)C 271570a_100102525489_100000742759 [0,1,1,0,0,0|2,0,0]=4 1973 B11R1.157 CC(=Cc1cccc(n1)F)C 271570a_100102525489_100009815982 [0,1,1,0,0,0|2,0,0]=4 1974 B11R1.157 CC(=Cc1cccc(n1)N)C 271570a_100102525489_100000740741 [0,1,1,0,0,0|2,0,0]=4 1975 B11R1.157 CC(=Cc1ccnc(c1)Br)C 271570a_100102525489_100009814637 [0,1,1,0,0,0|2,0,0]=4 1976 B11R1.157 CC(=Cc1ccnc(c1)C)C 271570a_100102525489_100000758586 [0,1,1,0,0,0|2,0,0]=4 1977 B11R1.157 CC(=Cc1ccnc(c1)Cl)C 271570a_100102525489_100000035001 [0,1,1,0,0,0|2,0,0]=4 1978 B11R1.157 CC(=Cc1ccnc(c1)F)C 271570a_100102525489_100009816116 [0,1,1,0,0,0|2,0,0]=4 1979 B11R1.157 CC(=Cc1ccnc(c1)N)C 271570a_100102525489_100000744379 [0,1,1,0,0,0|2,0,0]=4 1980 B11R1.157 CC(=Cc1cncc(c1)Br)C 271570a_100102525489_100000728054 [0,1,1,0,0,0|2,0,0]=4 1981 B11R1.157 CC(=Cc1cncc(c1)C)C 271570a_100102525489_100000760492 [0,1,1,0,0,0|2,0,0]=4 1982 B11R1.157 CC(=Cc1cncc(c1)Cl)C 271570a_100102525489_100000049639 [0,1,1,0,0,0|2,0,0]=4 1983 B11R1.157 CC(=Cc1cncc(c1)F)C 271570a_100102525489_100000744099 [0,1,1,0,0,0|2,0,0]=4 1984 B11R1.157 CC(=Cc1cncc(c1)N)C 271570a_100102525489_100000687067 [0,1,1,0,0,0|2,0,0]=4 1985 B11R1.157 CC(=Cc1cncc(c1)O)C 271570a_100102525489_100000754920 [0,1,1,0,0,0|2,0,0]=4 1986 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000070787_100000211773 [0,1,1,0,0,0|0,0,2]=4 1987 B11R1.157 CC(=O)Cc1cccc(c1)Br 1458a_100000747190_200000210301 [0,1,1,0,0,0|0,0,2]=4 1988 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100000070787_100000211840 [0,1,1,0,0,0|0,0,2]=4 1989 B11R1.157 CC(=O)Cc1cccc(c1)C 1458a_100011206899_200000210301 [0,1,1,0,0,0|0,0,2]=4 1990 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000070787_100000181238 [0,1,1,0,0,0|0,0,2]=4 1991 B11R1.157 CC(=O)Cc1cccc(c1)Cl 1458a_100000749307_200000210301 [0,1,1,0,0,0|0,0,2]=4 1992 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000070787_100000230114 [0,1,1,0,0,0|0,0,2]=4 1993 B11R1.157 CC(=O)Cc1cccc(c1)F 1458a_100000211661_200000210301 [0,1,1,0,0,0|0,0,2]=4 1994 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000070787_100011218688 [0,1,1,0,0,0|0,0,2]=4 1995 B11R1.157 CC(=O)Cc1cccc(c1)I 1458a_100000238430_200000210301 [0,1,1,0,0,0|0,0,2]=4 1996 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000070787_100011660834 [0,1,1,0,0,0|0,0,2]=4 1997 B11R1.157 CC(=O)Cc1cccc(c1)O 1458a_100000745134_200000210301 [0,1,1,0,0,0|0,0,2]=4 1998 B11R1.157 CC(=O)Cc1cccc(c1)O 271570a_203496583355_100000689217 [0,1,1,0,0,0|0,0,2]=4 1999 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,1,1,0,0,0|1,0,1]=4 2000 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,1,1,0,0,0|1,0,1]=4 2001 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,1,1,0,0,0|1,0,1]=4 2002 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,1,1,0,0,0|1,0,1]=4 2003 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,1,1,0,0,0|1,0,1]=4 2004 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,1,1,0,0,0|1,0,1]=4 2005 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,1,1,0,0,0|1,0,1]=4 2006 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,1,1,0,0,0|1,0,1]=4 2007 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,1,1,0,0,0|1,0,1]=4 2008 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,1,1,0,0,0|1,0,1]=4 2009 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,1,1,0,0,0|1,0,1]=4 2010 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,1,1,0,0,0|1,0,1]=4 2011 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,1,1,0,0,0|1,0,1]=4 2012 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,1,1,0,0,0|1,0,1]=4 2013 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,1,1,0,0,0|1,0,1]=4 2014 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,1,1,0,0,0|1,0,1]=4 2015 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,1,1,0,0,0|1,0,1]=4 2016 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,1,1,0,0,0|1,0,1]=4 2017 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,1,1,0,0,0|1,0,1]=4 2018 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,1,1,0,0,0|1,0,1]=4 2019 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,1,1,0,0,0|1,0,1]=4 2020 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,1,1,0,0,0|1,0,1]=4 2021 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,1,1,0,0,0|1,0,1]=4 2022 B11R1.157 CC(=O)Oc1cccc(c1)O 271570a_203496583355_100009811612 [0,1,1,0,0,0|1,0,0]=3 2023 B11R1.157 CC(C)Oc1cccc(c1)Br 34a_100000210342_100000210206 [0,1,1,0,0,0|0,0,2]=4 2024 B11R1.157 CC(C)Oc1cccc(c1)Br 7a_100000210342_100000210206 [0,1,1,0,0,0|0,0,2]=4 2025 B11R1.157 CC(C)Oc1cccc(c1)Cl 34a_100000210295_100000210206 [0,1,1,0,0,0|0,0,2]=4 2026 B11R1.157 CC(C)Oc1cccc(c1)Cl 7a_100000210295_100000210206 [0,1,1,0,0,0|0,0,2]=4 2027 B11R1.157 CC(C)Oc1cccc(c1)F 34a_100000210426_100000210206 [0,1,1,0,0,0|0,0,2]=4 2028 B11R1.157 CC(C)Oc1cccc(c1)F 7a_100000210426_100000210206 [0,1,1,0,0,0|0,0,2]=4 2029 B11R1.157 CC(C)Oc1cccc(c1)I 34a_100000211634_100000210206 [0,1,1,0,0,0|0,0,2]=4 2030 B11R1.157 CC(C)Oc1cccc(c1)I 7a_100000211634_100000210206 [0,1,1,0,0,0|0,0,2]=4 2031 B11R1.157 CC(C)Oc1cccc(c1)N 34a_100000210217_100000210206 [0,1,1,0,0,0|0,0,2]=4 2032 B11R1.157 CC(C)Oc1cccc(c1)O 271570a_203496583355_100000170003 [0,1,1,0,0,0|0,0,2]=4 2033 B11R1.157 Cc1cccc(c1)CC(=O)[13CH3] 1458a_100011206899_200025704644 [0,1,1,0,0,0|0,0,2]=4 2034 B11R1.157 Cc1cccc(c1)OC(C)C 34a_100000210337_100000210206 [0,1,1,0,0,0|0,0,2]=4 2035 B11R1.157 Cc1cccc(c1)OC(C)C 7a_100000210337_100000210206 [0,1,1,0,0,0|0,0,2]=4 2036 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Br 1458a_100000747190_200025704644 [0,1,1,0,0,0|0,0,2]=4 2037 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)Cl 1458a_100000749307_200025704644 [0,1,1,0,0,0|0,0,2]=4 2038 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)F 1458a_100000211661_200025704644 [0,1,1,0,0,0|0,0,2]=4 2039 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)I 1458a_100000238430_200025704644 [0,1,1,0,0,0|0,0,2]=4 2040 B11R1.157 [13CH3]C(=O)Cc1cccc(c1)O 1458a_100000745134_200025704644 [0,1,1,0,0,0|0,0,2]=4 2041 B11R1.509 CC(C)(C)Oc1ccccc1 34a_100000210340_100000210625 [0,1,1,0,0,0|0,0,2]=4 2042 B11R1.49 C=C(C)c1cc(sc1C=O)C 271570a_100000694244_100011361552 [0,1,1,0,0,0|1,1,0]=4 2043 B11R1.183 C=C=Cc1cc(sc1C=O)C 271570a_100015277604_100011361552 [0,1,1,0,0,0|1,1,0]=4 2044 B11R1.183 CC=Cc1cc(sc1C=O)C 271570a_100016259895_100011361552 [0,1,1,0,0,0|1,1,0]=4 2045 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [1,1,0,0,0,0|2,0,0]=4 2046 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [1,1,0,0,0,0|2,0,0]=4 2047 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [1,1,0,0,0,0|2,0,0]=4 2048 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [1,1,0,0,0,0|2,0,0]=4 2049 B11R2.1 Oc1cnc2n1cccc2 271570a_203496583355_100011219245 [1,1,0,0,0,0|2,0,0]=4 2050 B11R2.1 Oc1cnn2c1cccc2 271570a_203496583355_100009817726 [1,1,0,0,0,0|2,0,0]=4 2051 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [1,1,0,0,0,0|0,0,0]=2 2052 B11R2.1 Oc1coc2c1nccc2 271570a_203496583355_100009889148 [1,1,0,0,0,0|1,0,0]=3 2053 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [1,1,0,0,0,0|0,1,0]=3 2054 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [1,1,0,0,0,0|1,1,0]=4 2055 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [1,1,0,0,0,0|1,1,0]=4 2056 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [1,1,0,0,0,0|1,1,0]=4 2057 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [1,1,0,0,0,0|1,1,0]=4 2058 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,1,0,0,0,0|2,0,0]=4 2059 B11R2.36 Oc1cc2[nH]ccc2cn1 271570a_203496583355_100000089685 [1,1,0,0,0,0|2,0,0]=4 2060 B11R2.36 Oc1cc2cc[nH]c2cn1 271570a_203496583355_100009864809 [1,1,0,0,0,0|2,0,0]=4 2061 B11R2.36 Oc1cc2sccc2cn1 271570a_203496583355_200016184645 [1,1,0,0,0,0|1,1,0]=4 2062 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,1,0,0,0,0|1,0,0]=3 2063 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [1,1,0,0,0,0|2,0,0]=4 2064 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,1,0,0,0,0|2,0,0]=4 2065 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,1,0,0,0,0|2,0,0]=4 2066 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,1,0,0,0,0|1,0,0]=3 2067 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,1,0,0,0,0|1,0,0]=3 2068 B11R2.36 Oc1ccc2c(c1)CCO2 271570a_203496583355_100000729065 [1,1,0,0,0,0|0,0,2]=4 2069 B11R2.36 Oc1ccc2c(c1)OCC2 271570a_203496583355_100009818566 [1,1,0,0,0,0|0,0,2]=4 2070 B11R2.36 Oc1ccc2c(c1)OCO2 271570a_203496583355_100000688060 [1,1,0,0,0,0|1,0,1]=4 2071 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,1,0,0,0,0|1,0,0]=3 2072 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [1,1,0,0,0,0|2,0,0]=4 2073 B11R2.36 Oc1ccc2ccnn2c1 271570a_203496583355_100009820231 [1,1,0,0,0,0|2,0,0]=4 2074 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,1,0,0,0,0|0,0,0]=2 2075 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,1,0,0,0,0|0,1,0]=3 2076 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,1,0,0,0,0|2,0,0]=4 2077 B11R2.36 Oc1ccc2cnoc2c1 271570a_203496583355_100009817722 [1,1,0,0,0,0|1,0,0]=3 2078 B11R2.36 Oc1ccc2cscc2c1 271570a_203496583355_200010760811 [1,1,0,0,0,0|2,0,0]=4 2079 B11R2.36 Oc1ccc2csnc2c1 271570a_203496583355_100010170880 [1,1,0,0,0,0|2,0,0]=4 2080 B11R2.36 Oc1ccc2nccn2c1 271570a_203496583355_100000746083 [1,1,0,0,0,0|2,0,0]=4 2081 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,1,0,0,0,0|1,0,0]=3 2082 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [1,1,0,0,0,0|1,1,0]=4 2083 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,1,0,0,0,0|0,0,0]=2 2084 B11R2.36 Oc1ccc2occc2n1 271570a_203496583355_100009851292 [1,1,0,0,0,0|1,0,0]=3 2085 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,1,0,0,0,0|1,0,0]=3 2086 B11R2.36 Oc1ccc2oncc2c1 271570a_203496583355_100009817723 [1,1,0,0,0,0|1,0,0]=3 2087 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,1,0,0,0,0|0,1,0]=3 2088 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [1,1,0,0,0,0|1,1,0]=4 2089 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [1,1,0,0,0,0|1,1,0]=4 2090 B11R2.36 Oc1ccn2ccnc2c1 271570a_203496583355_100009816855 [1,1,0,0,0,0|2,0,0]=4 2091 B11R2.36 Oc1ccn2nccc2c1 271570a_203496583355_100000763084 [1,1,0,0,0,0|2,0,0]=4 2092 B11R2.36 Oc1cnc2[nH]ccc2c1 271570a_203496583355_100000760471 [1,1,0,0,0,0|2,0,0]=4 2093 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [1,1,0,0,0,0|2,0,0]=4 2094 B11R2.36 Oc1cnc2ncoc2c1 271570a_203496583355_100000721906 [1,1,0,0,0,0|2,0,0]=4 2095 B11R2.36 Oc1cnc2sccc2c1 271570a_203496583355_100010135160 [1,1,0,0,0,0|1,1,0]=4 2096 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,1,0,0,0,0|1,0,0]=3 2097 B11R2.106 Oc1cccc2c1CCO2 271570a_203496583355_100009819624 [1,1,0,0,0,0|0,0,2]=4 2098 B11R2.106 Oc1cccc2c1OCC2 271570a_203496583355_100009818991 [1,1,0,0,0,0|0,0,2]=4 2099 B11R2.106 Oc1cccc2c1OCO2 271570a_203496583355_100009814252 [1,1,0,0,0,0|1,0,1]=4 2100 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,1,0,0,0,0|1,0,0]=3 2101 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,1,0,0,0,0|2,0,0]=4 2102 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,1,0,0,0,0|1,0,0]=3 2103 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,1,0,0,0,0|0,0,0]=2 2104 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,1,0,0,0,0|0,1,0]=3 2105 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [1,1,0,0,0,0|2,0,0]=4 2106 B11R2.106 Oc1cccc2c1cno2 271570a_203496583355_100009818589 [1,1,0,0,0,0|1,0,0]=3 2107 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [1,1,0,0,0,0|2,0,0]=4 2108 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,1,0,0,0,0|1,0,0]=3 2109 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [1,1,0,0,0,0|1,1,0]=4 2110 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,1,0,0,0,0|0,0,0]=2 2111 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,1,0,0,0,0|1,0,0]=3 2112 B11R2.106 Oc1cccc2c1onc2 271570a_203496583355_100000765530 [1,1,0,0,0,0|1,0,0]=3 2113 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,1,0,0,0,0|0,1,0]=3 2114 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [1,1,0,0,0,0|1,1,0]=4 2115 B11R2.106 Oc1cccc2n1ccn2 271570a_203496583355_100000762677 [1,1,0,0,0,0|2,0,0]=4 2116 B11R2.106 Oc1cccc2n1ncc2 271570a_203496583355_100009817731 [1,1,0,0,0,0|2,0,0]=4 2117 B11R2.106 Oc1cccn2c1ccn2 271570a_203496583355_100010767162 [1,1,0,0,0,0|2,0,0]=4 2118 B11R2.106 Oc1cccn2c1ncc2 271570a_203496583355_100011934911 [1,1,0,0,0,0|2,0,0]=4 2119 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [1,1,0,0,0,0|2,0,0]=4 2120 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [1,1,0,0,0,0|2,0,0]=4 2121 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [1,1,0,0,0,0|1,1,0]=4 2122 B11R2.106 Oc1ccnc2c1occ2 271570a_203496583355_100009853057 [1,1,0,0,0,0|1,0,0]=3 2123 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [1,1,0,0,0,0|1,1,0]=4 2124 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [1,1,0,0,0,0|2,0,0]=4 2125 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [1,1,0,0,0,0|2,0,0]=4 2126 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [1,1,0,0,0,0|2,0,0]=4 2127 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [1,1,0,0,0,0|2,0,0]=4 2128 B11R2.106 Oc1nccc2c1cco2 271570a_203496583355_100000041166 [1,1,0,0,0,0|1,0,0]=3 2129 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [1,1,0,0,0,0|1,1,0]=4 2130 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [1,1,0,0,0,0|1,1,0]=4 2131 B11R2.106 Oc1ncnc2c1cco2 271570a_203496583355_100000094286 [1,1,0,0,0,0|2,0,0]=4 2132 B11R2.15 CSc1cc2sccc2s1 62a_200000210301_200010191111 [0,1,0,0,1,0|1,1,0]=4 2133 B11R2.15 [13CH3]Sc1cc2sccc2s1 62a_200025704644_200010191111 [0,1,0,0,1,0|1,1,0]=4 2134 B11R2.988 CNC1Cc2c1cccc2 7a_106832991635_100009813401 [0,1,0,0,1,0|0,0,2]=4 2135 B11R2.988 CSC1Cc2c1cccc2 62a_100009813401_200000210301 [0,1,0,0,1,0|0,0,2]=4 2136 B11R2.988 CSC1Cc2c1cccc2 62a_200000210301_100009813401 [0,1,0,0,1,0|0,0,2]=4 2137 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_100009813401_200025704644 [0,1,0,0,1,0|0,0,2]=4 2138 B11R2.988 [13CH3]SC1Cc2c1cccc2 62a_200025704644_100009813401 [0,1,0,0,1,0|0,0,2]=4 2139 B13R2.32 Cc1c(ccc2c1cccc2)O 271570a_203496583355_100010221197 [0,1,0,0,0,1|2,0,0]=4 2140 B13R2.32 Cc1ccc2ccccc2c1O 271570a_203496583355_100000759710 [0,1,0,0,0,1|1,0,0]=3 2141 B13R2.32 Cc1ccc2cnccc2c1O 271570a_203496583355_100010204589 [0,1,0,0,0,1|2,0,0]=4 2142 B13R2.32 Cc1cnc2ccccc2c1O 271570a_203496583355_100000092342 [0,1,0,0,0,1|1,0,0]=3 2143 B13R2.32 Nc1c(ccc2c1cccc2)O 271570a_203496583355_100009817101 [0,1,0,0,0,1|2,0,0]=4 2144 B13R2.32 Nc1c(cnc2c1cccc2)O 271570a_203496583355_100009995562 [0,1,0,0,0,1|2,0,0]=4 2145 B13R2.32 Nc1c(ncc2c1cccc2)O 271570a_203496583355_100000087573 [0,1,0,0,0,1|2,0,0]=4 2146 B13R2.32 Nc1ccc2ccccc2c1O 271570a_203496583355_100000705303 [0,1,0,0,0,1|2,0,0]=4 2147 B13R2.32 Nc1cnc2ccccc2c1O 271570a_203496583355_100012243074 [0,1,0,0,0,1|2,0,0]=4 2148 B13R2.32 Nc1ncc2ccccc2c1O 271570a_203496583355_100009994184 [0,1,0,0,0,1|2,0,0]=4 2149 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,1|2,0,0]=4 2150 B13R2.32 O=c1c(coc2c1cccc2)O 271570a_203496583355_100009813851 [0,1,0,0,0,1|1,0,0]=3 2151 B13R2.32 Oc1c(ccc2c1cccc2)Br 271570a_203496583355_100010090040 [0,1,0,0,0,1|2,0,0]=4 2152 B13R2.32 Oc1c(cnc2c1cccc2)Br 271570a_203496583355_200010179490 [0,1,0,0,0,1|2,0,0]=4 2153 B13R2.32 Oc1ccc2ccccc2c1Br 271570a_203496583355_200010089984 [0,1,0,0,0,1|2,0,0]=4 2154 B13R2.32 Oc1ccc2ccccc2c1F 271570a_203496583355_100009832041 [0,1,0,0,0,1|2,0,0]=4 2155 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100000183829 [0,1,0,0,0,1|2,0,0]=4 2156 B13R2.32 Oc1ccc2ccccc2c1O 271570a_203496583355_100009996032 [0,1,0,0,0,1|2,0,0]=4 2157 B13R2.32 Oc1cnc2ccccc2c1Cl 271570a_203496583355_100012352519 [0,1,0,0,0,1|2,0,0]=4 2158 B13R2.32 Oc1nnc2ccccc2c1O 271570a_203496583355_100000688347 [0,1,0,0,0,1|2,0,0]=4 2159 B13R2.57 C=Cc1cc2ccccc2cn1 271570a_100011290941_100000047361 [0,1,0,0,0,1|1,0,1]=4 2160 B13R2.57 C=Cc1ccc2ccccc2c1 271570a_100011290941_100000233703 [0,1,0,0,0,1|1,0,1]=4 2161 B13R2.57 C=Cc1ccc2ccccc2n1 271570a_100011290941_100011291633 [0,1,0,0,0,1|1,0,1]=4 2162 B13R2.57 C=Cc1cnc2ccccc2c1 271570a_100011290941_100000737414 [0,1,0,0,0,1|1,0,1]=4 2163 B13R2.57 C=Cc1cnc2ccccc2n1 271570a_100011290941_100000756483 [0,1,0,0,0,1|1,0,1]=4 2164 B13R2.57 C=Cc1ncc2ccccc2n1 271570a_100011290941_100000097389 [0,1,0,0,0,1|1,0,1]=4 2165 B13R2.57 CNC1COc2ccccc2C1 2230a_100000739546_200000210301 [0,1,0,0,0,1|0,0,2]=4 2166 B13R2.57 CNC1COc2ccccc2C1 270004a_106832991635_100000048293 [0,1,0,0,0,1|0,0,2]=4 2167 B13R2.57 CNc1ccc2ccccc2c1 34a_100000211940_200000210301 [0,1,0,0,0,1|1,0,0]=3 2168 B13R2.57 CNc1ccc2ccccc2c1 7a_100000211940_200000210301 [0,1,0,0,0,1|1,0,0]=3 2169 B13R2.57 CNc1ccc2ccccc2n1 27a_100102657272_100011291633 [0,1,0,0,0,1|1,0,0]=3 2170 B13R2.57 CNc1ccc2cccnc2c1 34a_100102887122_200000210301 [0,1,0,0,0,1|2,0,0]=4 2171 B13R2.57 CNc1ccc2cccnc2n1 27a_100102657272_100000075685 [0,1,0,0,0,1|2,0,0]=4 2172 B13R2.57 CNc1ccc2ccncc2n1 27a_100102657272_100000020162 [0,1,0,0,0,1|2,0,0]=4 2173 B13R2.57 CNc1ccc2cnccc2c1 34a_100000039641_200000210301 [0,1,0,0,0,1|2,0,0]=4 2174 B13R2.57 CNc1ccc2ncccc2c1 34a_100011198106_200000210301 [0,1,0,0,0,1|2,0,0]=4 2175 B13R2.57 CNc1ccc2ncccc2n1 27a_100102657272_100000073381 [0,1,0,0,0,1|2,0,0]=4 2176 B13R2.57 CNc1cnc2ccccc2n1 27a_100102657272_100000756483 [0,1,0,0,0,1|1,0,0]=3 2177 B13R2.57 CNc1cnc2cccnc2n1 27a_100102657272_200010275043 [0,1,0,0,0,1|2,0,0]=4 2178 B13R2.57 CNc1cnc2ncccc2n1 27a_100102657272_100000084304 [0,1,0,0,0,1|2,0,0]=4 2179 B13R2.57 CNc1ncc2ccccc2n1 27a_100102657272_100000097389 [0,1,0,0,0,1|1,0,0]=3 2180 B13R2.57 CNc1ncc2cccnc2n1 27a_100102657272_100009875485 [0,1,0,0,0,1|2,0,0]=4 2181 B13R2.57 COC1Cc2ccccc2CO1 34a_200000095866_200000210301 [0,1,0,0,0,1|0,0,2]=4 2182 B13R2.57 COc1ccc2ccccc2c1 34a_100000185828_200000210301 [0,1,0,0,0,1|1,0,0]=3 2183 B13R2.57 COc1ccc2ccccc2c1 7a_100000185828_200000210301 [0,1,0,0,0,1|1,0,0]=3 2184 B13R2.57 COc1ccc2cccnc2c1 34a_100011216045_200000210301 [0,1,0,0,0,1|2,0,0]=4 2185 B13R2.57 COc1ccc2ccncc2c1 7a_100000752006_200000210301 [0,1,0,0,0,1|2,0,0]=4 2186 B13R2.57 COc1ccc2cnccc2c1 34a_100000046372_200000210301 [0,1,0,0,0,1|2,0,0]=4 2187 B13R2.57 COc1ccc2cnccc2c1 7a_100000046372_200000210301 [0,1,0,0,0,1|2,0,0]=4 2188 B13R2.57 COc1ccc2ncccc2c1 34a_100011215586_200000210301 [0,1,0,0,0,1|2,0,0]=4 2189 B13R2.57 COc1ccc2ncccc2c1 7a_100011215586_200000210301 [0,1,0,0,0,1|2,0,0]=4 2190 B13R2.57 COc1cnc2ccccc2c1 34a_100011934006_200000210301 [0,1,0,0,0,1|1,0,0]=3 2191 B13R2.57 COc1cnc2ccccc2c1 7a_100011934006_200000210301 [0,1,0,0,0,1|1,0,0]=3 2192 B13R2.57 CSc1cc2ccccc2cn1 62a_100009816522_200000210301 [0,1,0,0,0,1|1,0,0]=3 2193 B13R2.57 CSc1cc2ccccc2cn1 62a_200000210301_100000047361 [0,1,0,0,0,1|1,0,0]=3 2194 B13R2.57 CSc1ccc2ccccc2c1 62a_200000210301_100000233703 [0,1,0,0,0,1|1,0,0]=3 2195 B13R2.57 CSc1ccc2ccccc2n1 62a_100011291633_200000210301 [0,1,0,0,0,1|1,0,0]=3 2196 B13R2.57 CSc1ccc2ccccc2n1 62a_200000210301_100011291633 [0,1,0,0,0,1|1,0,0]=3 2197 B13R2.57 CSc1ccc2cccnc2c1 62a_200000210301_100009816655 [0,1,0,0,0,1|2,0,0]=4 2198 B13R2.57 CSc1ccc2cccnc2n1 62a_100000075685_200000210301 [0,1,0,0,0,1|2,0,0]=4 2199 B13R2.57 CSc1ccc2cccnc2n1 62a_200000210301_100000075685 [0,1,0,0,0,1|2,0,0]=4 2200 B13R2.57 CSc1ccc2ccncc2c1 62a_100000686496_200000210301 [0,1,0,0,0,1|2,0,0]=4 2201 B13R2.57 CSc1ccc2ccncc2c1 62a_200000210301_100000686496 [0,1,0,0,0,1|2,0,0]=4 2202 B13R2.57 CSc1ccc2ccncc2n1 62a_200000210301_100000020162 [0,1,0,0,0,1|2,0,0]=4 2203 B13R2.57 CSc1ccc2cnccc2c1 62a_100009816743_200000210301 [0,1,0,0,0,1|2,0,0]=4 2204 B13R2.57 CSc1ccc2cnccc2c1 62a_200000210301_100009816743 [0,1,0,0,0,1|2,0,0]=4 2205 B13R2.57 CSc1ccc2ncccc2c1 62a_100011215947_200000210301 [0,1,0,0,0,1|2,0,0]=4 2206 B13R2.57 CSc1ccc2ncccc2c1 62a_200000210301_100011215947 [0,1,0,0,0,1|2,0,0]=4 2207 B13R2.57 CSc1ccc2ncccc2n1 62a_200000210301_100000073381 [0,1,0,0,0,1|2,0,0]=4 2208 B13R2.57 CSc1cnc2ccccc2c1 62a_200000210301_100000737414 [0,1,0,0,0,1|1,0,0]=3 2209 B13R2.57 CSc1cnc2ccccc2n1 62a_100000756483_200000210301 [0,1,0,0,0,1|1,0,0]=3 2210 B13R2.57 CSc1cnc2ccccc2n1 62a_200000210301_100000756483 [0,1,0,0,0,1|1,0,0]=3 2211 B13R2.57 CSc1cnc2cccnc2c1 62a_100010246316_200000210301 [0,1,0,0,0,1|2,0,0]=4 2212 B13R2.57 CSc1cnc2cccnc2c1 62a_200000210301_100010246316 [0,1,0,0,0,1|2,0,0]=4 2213 B13R2.57 CSc1cnc2cccnc2n1 62a_200000210301_200010275043 [0,1,0,0,0,1|2,0,0]=4 2214 B13R2.57 CSc1cnc2cccnc2n1 62a_200010275043_200000210301 [0,1,0,0,0,1|2,0,0]=4 2215 B13R2.57 CSc1cnc2ncccc2n1 62a_100000084304_200000210301 [0,1,0,0,0,1|2,0,0]=4 2216 B13R2.57 CSc1cnc2ncccc2n1 62a_200000210301_100000084304 [0,1,0,0,0,1|2,0,0]=4 2217 B13R2.57 CSc1ncc2ccccc2n1 62a_200000210301_100000097389 [0,1,0,0,0,1|1,0,0]=3 2218 B13R2.57 CSc1ncc2cccnc2n1 62a_100009875485_200000210301 [0,1,0,0,0,1|2,0,0]=4 2219 B13R2.57 CSc1ncc2cccnc2n1 62a_200000210301_100009875485 [0,1,0,0,0,1|2,0,0]=4 2220 B13R2.57 [13CH3]NC1COc2ccccc2C1 2230a_100000739546_200025704644 [0,1,0,0,0,1|0,0,2]=4 2221 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 34a_100000211940_200025704644 [0,1,0,0,0,1|1,0,0]=3 2222 B13R2.57 [13CH3]Nc1ccc2ccccc2c1 7a_100000211940_200025704644 [0,1,0,0,0,1|1,0,0]=3 2223 B13R2.57 [13CH3]Nc1ccc2cccnc2c1 34a_100102887122_200025704644 [0,1,0,0,0,1|2,0,0]=4 2224 B13R2.57 [13CH3]Nc1ccc2cnccc2c1 34a_100000039641_200025704644 [0,1,0,0,0,1|2,0,0]=4 2225 B13R2.57 [13CH3]Nc1ccc2ncccc2c1 34a_100011198106_200025704644 [0,1,0,0,0,1|2,0,0]=4 2226 B13R2.57 [13CH3]OC1Cc2ccccc2CO1 34a_200000095866_200025704644 [0,1,0,0,0,1|0,0,2]=4 2227 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 34a_100000185828_200025704644 [0,1,0,0,0,1|1,0,0]=3 2228 B13R2.57 [13CH3]Oc1ccc2ccccc2c1 7a_100000185828_200025704644 [0,1,0,0,0,1|1,0,0]=3 2229 B13R2.57 [13CH3]Oc1ccc2cccnc2c1 34a_100011216045_200025704644 [0,1,0,0,0,1|2,0,0]=4 2230 B13R2.57 [13CH3]Oc1ccc2ccncc2c1 7a_100000752006_200025704644 [0,1,0,0,0,1|2,0,0]=4 2231 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 34a_100000046372_200025704644 [0,1,0,0,0,1|2,0,0]=4 2232 B13R2.57 [13CH3]Oc1ccc2cnccc2c1 7a_100000046372_200025704644 [0,1,0,0,0,1|2,0,0]=4 2233 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 34a_100011215586_200025704644 [0,1,0,0,0,1|2,0,0]=4 2234 B13R2.57 [13CH3]Oc1ccc2ncccc2c1 7a_100011215586_200025704644 [0,1,0,0,0,1|2,0,0]=4 2235 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 34a_100011934006_200025704644 [0,1,0,0,0,1|1,0,0]=3 2236 B13R2.57 [13CH3]Oc1cnc2ccccc2c1 7a_100011934006_200025704644 [0,1,0,0,0,1|1,0,0]=3 2237 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_100009816522_200025704644 [0,1,0,0,0,1|1,0,0]=3 2238 B13R2.57 [13CH3]Sc1cc2ccccc2cn1 62a_200025704644_100000047361 [0,1,0,0,0,1|1,0,0]=3 2239 B13R2.57 [13CH3]Sc1ccc2ccccc2c1 62a_200025704644_100000233703 [0,1,0,0,0,1|1,0,0]=3 2240 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_100011291633_200025704644 [0,1,0,0,0,1|1,0,0]=3 2241 B13R2.57 [13CH3]Sc1ccc2ccccc2n1 62a_200025704644_100011291633 [0,1,0,0,0,1|1,0,0]=3 2242 B13R2.57 [13CH3]Sc1ccc2cccnc2c1 62a_200025704644_100009816655 [0,1,0,0,0,1|2,0,0]=4 2243 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_100000075685_200025704644 [0,1,0,0,0,1|2,0,0]=4 2244 B13R2.57 [13CH3]Sc1ccc2cccnc2n1 62a_200025704644_100000075685 [0,1,0,0,0,1|2,0,0]=4 2245 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_100000686496_200025704644 [0,1,0,0,0,1|2,0,0]=4 2246 B13R2.57 [13CH3]Sc1ccc2ccncc2c1 62a_200025704644_100000686496 [0,1,0,0,0,1|2,0,0]=4 2247 B13R2.57 [13CH3]Sc1ccc2ccncc2n1 62a_200025704644_100000020162 [0,1,0,0,0,1|2,0,0]=4 2248 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_100009816743_200025704644 [0,1,0,0,0,1|2,0,0]=4 2249 B13R2.57 [13CH3]Sc1ccc2cnccc2c1 62a_200025704644_100009816743 [0,1,0,0,0,1|2,0,0]=4 2250 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_100011215947_200025704644 [0,1,0,0,0,1|2,0,0]=4 2251 B13R2.57 [13CH3]Sc1ccc2ncccc2c1 62a_200025704644_100011215947 [0,1,0,0,0,1|2,0,0]=4 2252 B13R2.57 [13CH3]Sc1ccc2ncccc2n1 62a_200025704644_100000073381 [0,1,0,0,0,1|2,0,0]=4 2253 B13R2.57 [13CH3]Sc1cnc2ccccc2c1 62a_200025704644_100000737414 [0,1,0,0,0,1|1,0,0]=3 2254 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_100000756483_200025704644 [0,1,0,0,0,1|1,0,0]=3 2255 B13R2.57 [13CH3]Sc1cnc2ccccc2n1 62a_200025704644_100000756483 [0,1,0,0,0,1|1,0,0]=3 2256 B13R2.57 [13CH3]Sc1cnc2cccnc2c1 62a_100010246316_200025704644 [0,1,0,0,0,1|2,0,0]=4 2257 B13R2.57 [13CH3]Sc1cnc2cccnc2c1 62a_200025704644_100010246316 [0,1,0,0,0,1|2,0,0]=4 2258 B13R2.57 [13CH3]Sc1cnc2cccnc2n1 62a_200010275043_200025704644 [0,1,0,0,0,1|2,0,0]=4 2259 B13R2.57 [13CH3]Sc1cnc2cccnc2n1 62a_200025704644_200010275043 [0,1,0,0,0,1|2,0,0]=4 2260 B13R2.57 [13CH3]Sc1cnc2ncccc2n1 62a_100000084304_200025704644 [0,1,0,0,0,1|2,0,0]=4 2261 B13R2.57 [13CH3]Sc1cnc2ncccc2n1 62a_200025704644_100000084304 [0,1,0,0,0,1|2,0,0]=4 2262 B13R2.57 [13CH3]Sc1ncc2ccccc2n1 62a_200025704644_100000097389 [0,1,0,0,0,1|1,0,0]=3 2263 B13R2.57 [13CH3]Sc1ncc2cccnc2n1 62a_100009875485_200025704644 [0,1,0,0,0,1|2,0,0]=4 2264 B13R2.57 [13CH3]Sc1ncc2cccnc2n1 62a_200025704644_100009875485 [0,1,0,0,0,1|2,0,0]=4 2265 B13R2.155 CC1CNc2ccc(cc2O1)O 271570a_203496583355_200010108538 [0,1,0,0,0,1|0,0,2]=4 2266 B13R2.155 Cc1ccc2ccc(cc2n1)O 271570a_203496583355_100009817087 [0,1,0,0,0,1|1,0,0]=3 2267 B13R2.155 Cc1ccc2ncc(cc2c1)O 271570a_203496583355_100015841224 [0,1,0,0,0,1|2,0,0]=4 2268 B13R2.155 Cc1cnc2ccc(cc2c1)O 271570a_203496583355_100009817055 [0,1,0,0,0,1|1,0,0]=3 2269 B13R2.155 Cc1ncc2ccc(cc2n1)O 271570a_203496583355_100010233817 [0,1,0,0,0,1|1,0,0]=3 2270 B13R2.155 Nc1cc2cc(ccc2cn1)O 271570a_203496583355_100009817123 [0,1,0,0,0,1|2,0,0]=4 2271 B13R2.155 Nc1ccc2ccc(cc2c1)O 271570a_203496583355_100010090036 [0,1,0,0,0,1|2,0,0]=4 2272 B13R2.155 Nc1ccc2ccc(cc2n1)O 271570a_203496583355_100010187616 [0,1,0,0,0,1|2,0,0]=4 2273 B13R2.155 Nc1ccc2ncc(cc2c1)O 271570a_203496583355_100009888932 [0,1,0,0,0,1|2,0,0]=4 2274 B13R2.155 Nc1cnc2ccc(cc2n1)O 271570a_203496583355_100010090528 [0,1,0,0,0,1|2,0,0]=4 2275 B13R2.155 Nc1ncc2ccc(cc2n1)O 271570a_203496583355_100010199760 [0,1,0,0,0,1|2,0,0]=4 2276 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,0,0,1|2,0,0]=4 2277 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,0,0,1|2,0,0]=4 2278 B13R2.155 O=c1ccc2ccc(cc2o1)O 271570a_203496583355_100009993525 [0,1,0,0,0,1|1,0,0]=3 2279 B13R2.155 Oc1cc2cc(ccc2cn1)F 271570a_203496583355_100009828686 [0,1,0,0,0,1|2,0,0]=4 2280 B13R2.155 Oc1ccc2ccc(cc2c1)O 271570a_203496583355_100009816537 [0,1,0,0,0,1|2,0,0]=4 2281 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000079174 [0,1,0,0,0,1|2,0,0]=4 2282 B13R2.155 Oc1ccc2ccc(nc2c1)O 271570a_203496583355_100000690401 [0,1,0,0,0,1|2,0,0]=4 2283 B13R2.155 Oc1ccc2cnc(cc2c1)F 271570a_203496583355_100010291885 [0,1,0,0,0,1|2,0,0]=4 2284 B13R2.155 Oc1ccc2cnc(cc2c1)O 271570a_203496583355_100009817130 [0,1,0,0,0,1|2,0,0]=4 2285 B13R2.155 Oc1ccc2ncc(cc2c1)Br 271570a_203496583355_200010254249 [0,1,0,0,0,1|2,0,0]=4 2286 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100000703654 [0,1,0,0,0,1|2,0,0]=4 2287 B13R2.155 Oc1ccc2ncc(cc2c1)O 271570a_203496583355_100010137430 [0,1,0,0,0,1|2,0,0]=4 2288 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_100010000190 [0,1,0,0,0,1|2,0,0]=4 2289 B13R2.155 Oc1ccc2ncc(nc2c1)O 271570a_203496583355_200020640061 [0,1,0,0,0,1|2,0,0]=4 2290 B13R2.155 Oc1cnc2ccc(cc2c1)Br 271570a_203496583355_100010740133 [0,1,0,0,0,1|2,0,0]=4 2291 B13R2.155 Oc1cnc2ccc(cc2c1)Cl 271570a_203496583355_100015929906 [0,1,0,0,0,1|2,0,0]=4 2292 B13R2.155 Oc1ncc2ccc(cc2n1)F 271570a_203496583355_100000104070 [0,1,0,0,0,1|2,0,0]=4 2293 B13R2.162 Cc1ccc2cccc(c2n1)O 271570a_203496583355_100011934484 [0,1,0,0,0,1|1,0,0]=3 2294 B13R2.162 Cc1ccc2cncc(c2c1)O 271570a_203496583355_100009817139 [0,1,0,0,0,1|2,0,0]=4 2295 B13R2.162 Cc1ccc2nccc(c2c1)O 271570a_203496583355_100000751279 [0,1,0,0,0,1|2,0,0]=4 2296 B13R2.162 Cc1ccc2nccc(c2n1)O 271570a_203496583355_100009889967 [0,1,0,0,0,1|2,0,0]=4 2297 B13R2.162 Cc1cccc2c1cc(cc2)O 271570a_203496583355_100010089936 [0,1,0,0,0,1|2,0,0]=4 2298 B13R2.162 Cc1cccc2c1nc(cc2)O 271570a_203496583355_100012002297 [0,1,0,0,0,1|2,0,0]=4 2299 B13R2.162 Nc1ccc2cccc(c2n1)O 271570a_203496583355_100000687151 [0,1,0,0,0,1|2,0,0]=4 2300 B13R2.162 Nc1cccc2c1cc(cc2)O 271570a_203496583355_100010090012 [0,1,0,0,0,1|2,0,0]=4 2301 B13R2.162 Nc1cccc2c1cc(cn2)O 271570a_203496583355_100010264086 [0,1,0,0,0,1|2,0,0]=4 2302 B13R2.162 Nc1ncc2cccc(c2n1)O 271570a_203496583355_200010988910 [0,1,0,0,0,1|2,0,0]=4 2303 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,1|2,0,0]=4 2304 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010089991 [0,1,0,0,0,1|2,0,0]=4 2305 B13R2.162 Oc1ccc2cccc(c2c1)O 271570a_203496583355_100010169565 [0,1,0,0,0,1|2,0,0]=4 2306 B13R2.162 Oc1ccc2cccc(c2n1)F 271570a_203496583355_100012017632 [0,1,0,0,0,1|2,0,0]=4 2307 B13R2.162 Oc1ccc2cccc(c2n1)O 271570a_203496583355_100010153751 [0,1,0,0,0,1|2,0,0]=4 2308 B13R2.162 Oc1cnc2cccc(c2c1)O 271570a_203496583355_200010153752 [0,1,0,0,0,1|2,0,0]=4 2309 B13R2.162 Oc1ncc2cccc(c2n1)O 271570a_203496583355_100010674811 [0,1,0,0,0,1|2,0,0]=4 2310 B13R2.328 Cc1cc(c2ccccc2n1)O 271570a_203496583355_100000764982 [0,1,0,0,0,1|1,0,0]=3 2311 B13R2.328 Cc1cc(c2cccnc2n1)O 271570a_203496583355_100009885123 [0,1,0,0,0,1|2,0,0]=4 2312 B13R2.328 Cc1cc(c2ncccc2c1)O 271570a_203496583355_100010113427 [0,1,0,0,0,1|2,0,0]=4 2313 B13R2.328 Cc1cc(nc2c1cccc2)O 271570a_203496583355_100012354972 [0,1,0,0,0,1|2,0,0]=4 2314 B13R2.328 Cc1cc2ccccc2c(n1)O 271570a_203496583355_100000698243 [0,1,0,0,0,1|1,0,0]=3 2315 B13R2.328 Cc1nc(c2ccccc2n1)O 271570a_203496583355_100000230251 [0,1,0,0,0,1|1,0,0]=3 2316 B13R2.328 Cc1nc(nc2c1cccc2)O 271570a_203496583355_100000046098 [0,1,0,0,0,1|2,0,0]=4 2317 B13R2.328 Nc1cc(c2ccccc2c1)O 271570a_203496583355_100010089974 [0,1,0,0,0,1|2,0,0]=4 2318 B13R2.328 Nc1cc(cc2c1cccc2)O 271570a_203496583355_100010171453 [0,1,0,0,0,1|2,0,0]=4 2319 B13R2.328 Nc1cc(nc2c1cccc2)O 271570a_203496583355_100010197925 [0,1,0,0,0,1|2,0,0]=4 2320 B13R2.328 Nc1cc2ccccc2c(n1)O 271570a_203496583355_100009814382 [0,1,0,0,0,1|2,0,0]=4 2321 B13R2.328 Nc1nc(cc2c1cccc2)O 271570a_203496583355_100009957331 [0,1,0,0,0,1|2,0,0]=4 2322 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,1|2,0,0]=4 2323 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,1|2,0,0]=4 2324 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010001680 [0,1,0,0,0,1|2,0,0]=4 2325 B13R2.328 Oc1cc(c2ccccc2c1)O 271570a_203496583355_100010089979 [0,1,0,0,0,1|2,0,0]=4 2326 B13R2.328 [O-][n+]1cc(cc2c1cccc2)O 271570a_203496583355_200010000521 [0,1,0,0,0,1|2,0,0]=4 2327 B13R2.369 Cc1cc2ccccc2nc1O 271570a_203496583355_100000751756 [0,1,0,0,0,1|1,0,0]=3 2328 B13R2.369 Cc1cc2cccnc2nc1O 271570a_203496583355_100009877248 [0,1,0,0,0,1|2,0,0]=4 2329 B13R2.369 Cc1cc2ncccc2cc1O 271570a_203496583355_100010137429 [0,1,0,0,0,1|2,0,0]=4 2330 B13R2.369 Cc1nc2ccccc2nc1O 271570a_203496583355_100000185947 [0,1,0,0,0,1|1,0,0]=3 2331 B13R2.369 Nc1cc2ccccc2cc1O 271570a_203496583355_100009991566 [0,1,0,0,0,1|2,0,0]=4 2332 B13R2.369 Nc1nc2ccccc2cc1O 271570a_203496583355_100010135404 [0,1,0,0,0,1|2,0,0]=4 2333 B13R2.369 Nc1nc2ccccc2nc1O 271570a_203496583355_100000009970 [0,1,0,0,0,1|2,0,0]=4 2334 B13R2.369 O=c1oc2ccccc2cc1O 271570a_203496583355_200000187772 [0,1,0,0,0,1|1,0,0]=3 2335 B13R2.369 Oc1cc2ccccc2cc1Br 271570a_203496583355_200010169544 [0,1,0,0,0,1|2,0,0]=4 2336 B13R2.369 Oc1cc2ccccc2cc1Cl 271570a_203496583355_100010152806 [0,1,0,0,0,1|2,0,0]=4 2337 B13R2.369 Oc1cc2ccccc2cc1O 271570a_203496583355_100009817189 [0,1,0,0,0,1|2,0,0]=4 2338 B13R2.369 Oc1cc2ccccc2nc1Cl 271570a_203496583355_100010220712 [0,1,0,0,0,1|2,0,0]=4 2339 B13R2.369 Oc1cc2ccccc2nc1F 271570a_203496583355_100011158909 [0,1,0,0,0,1|2,0,0]=4 2340 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200000100762 [0,1,0,0,0,1|2,0,0]=4 2341 B13R2.369 Oc1cc2ccccc2nc1O 271570a_203496583355_200009820883 [0,1,0,0,0,1|2,0,0]=4 2342 B13R2.369 Oc1nc2ccccc2cc1Br 271570a_203496583355_100010072790 [0,1,0,0,0,1|2,0,0]=4 2343 B13R2.3683 C[n+]1ccc2cc(ccc2c1)O 271570a_203496583355_100015191232 [0,1,0,0,0,1|2,0,0]=4 2344 B13R2.3683 Cc1ccc2cc(ccc2n1)O 271570a_203496583355_100000686635 [0,1,0,0,0,1|1,0,0]=3 2345 B13R2.3683 Cc1ccc2nc(ccc2c1)O 271570a_203496583355_100011865911 [0,1,0,0,0,1|2,0,0]=4 2346 B13R2.3683 Cc1ccc2nc(ccc2n1)O 271570a_203496583355_200009884078 [0,1,0,0,0,1|2,0,0]=4 2347 B13R2.3683 Cc1cnc2cc(ccc2c1)O 271570a_203496583355_100010751441 [0,1,0,0,0,1|1,0,0]=3 2348 B13R2.3683 Nc1cc2ccc(cc2cn1)O 271570a_203496583355_100010232990 [0,1,0,0,0,1|2,0,0]=4 2349 B13R2.3683 Nc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185457 [0,1,0,0,0,1|2,0,0]=4 2350 B13R2.3683 Nc1ccc2cc(ccc2n1)O 271570a_203496583355_100011934619 [0,1,0,0,0,1|2,0,0]=4 2351 B13R2.3683 Nc1ccc2cc(cnc2c1)O 271570a_203496583355_200010264087 [0,1,0,0,0,1|2,0,0]=4 2352 B13R2.3683 Nc1ccc2nc(cnc2c1)O 271570a_203496583355_100009885871 [0,1,0,0,0,1|2,0,0]=4 2353 B13R2.3683 Nc1cnc2cc(ccc2c1)O 271570a_203496583355_100010142226 [0,1,0,0,0,1|2,0,0]=4 2354 B13R2.3683 Nc1ncc2cc(ccc2n1)O 271570a_203496583355_100010138702 [0,1,0,0,0,1|2,0,0]=4 2355 B13R2.3683 O=C1CCc2cc(ccc2O1)O 271570a_203496583355_100010179853 [0,1,0,0,0,1|1,0,1]=4 2356 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,1,0,0,0,1|2,0,0]=4 2357 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,1,0,0,0,1|2,0,0]=4 2358 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,1,0,0,0,1|2,0,0]=4 2359 B13R2.3683 O=c1ccc2cc(ccc2o1)O 271570a_203496583355_100009999946 [0,1,0,0,0,1|1,0,0]=3 2360 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,1,0,0,0,1|2,0,0]=4 2361 B13R2.3683 Oc1ccc2cc(ccc2c1)Br 271570a_203496583355_100012344972 [0,1,0,0,0,1|2,0,0]=4 2362 B13R2.3683 Oc1ccc2cc(ccc2c1)F 271570a_203496583355_100009817052 [0,1,0,0,0,1|2,0,0]=4 2363 B13R2.3683 Oc1ccc2cc(ccc2c1)O 271570a_203496583355_100000185455 [0,1,0,0,0,1|2,0,0]=4 2364 B13R2.3683 Oc1ccc2cc(ccc2n1)F 271570a_203496583355_100011998705 [0,1,0,0,0,1|2,0,0]=4 2365 B13R2.3683 Oc1ccc2cc(cnc2c1)Br 271570a_203496583355_200015509644 [0,1,0,0,0,1|2,0,0]=4 2366 B13R2.3683 Oc1ccc2cc(cnc2c1)F 271570a_203496583355_100010751466 [0,1,0,0,0,1|2,0,0]=4 2367 B13R2.3683 Oc1ccc2nc(ccc2c1)Cl 271570a_203496583355_200012034268 [0,1,0,0,0,1|2,0,0]=4 2368 B13R2.3683 Oc1ccc2nc(ccc2c1)O 271570a_203496583355_100009849208 [0,1,0,0,0,1|2,0,0]=4 2369 B13R2.3683 Oc1ccc2nc(cnc2c1)O 271570a_203496583355_200010664160 [0,1,0,0,0,1|2,0,0]=4 2370 B13R2.3683 Oc1cnc2cc(ccc2c1)Cl 271570a_203496583355_100015716233 [0,1,0,0,0,1|2,0,0]=4 2371 B13R2.3683 Oc1cnc2cc(ccc2c1)O 271570a_203496583355_200010153753 [0,1,0,0,0,1|2,0,0]=4 2372 B13R2.3683 Oc1cnc2cc(ccc2n1)F 271570a_203496583355_100000098432 [0,1,0,0,0,1|2,0,0]=4 2373 B13R2.5179 Cc1ccc2c(cccc2n1)O 271570a_203496583355_100010173736 [0,1,0,0,0,1|1,0,0]=3 2374 B13R2.5179 Cc1ccc2c(nccc2c1)O 271570a_203496583355_100000102439 [0,1,0,0,0,1|2,0,0]=4 2375 B13R2.5179 Cc1cccc2c1ncc(c2)O 271570a_203496583355_100009829671 [0,1,0,0,0,1|2,0,0]=4 2376 B13R2.5179 Nc1cc2cccc(c2cn1)O 271570a_203496583355_100010201637 [0,1,0,0,0,1|2,0,0]=4 2377 B13R2.5179 Nc1ccc2c(cccc2n1)O 271570a_203496583355_100000723655 [0,1,0,0,0,1|2,0,0]=4 2378 B13R2.5179 Nc1cccc2c1ccc(c2)O 271570a_203496583355_100010090037 [0,1,0,0,0,1|2,0,0]=4 2379 B13R2.5179 Nc1cccc2c1ncc(c2)O 271570a_203496583355_100000702407 [0,1,0,0,0,1|2,0,0]=4 2380 B13R2.5179 Nc1ncc2c(cccc2n1)O 271570a_203496583355_100010209551 [0,1,0,0,0,1|2,0,0]=4 2381 B13R2.5179 O=C1CCc2c(cccc2O1)O 271570a_203496583355_200015620928 [0,1,0,0,0,1|1,0,1]=4 2382 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,1|2,0,0]=4 2383 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,1|2,0,0]=4 2384 B13R2.5179 Oc1cc2cccc(c2cn1)O 271570a_203496583355_100009817091 [0,1,0,0,0,1|2,0,0]=4 2385 B13R2.5179 Oc1ccc2c(cccc2c1)O 271570a_203496583355_100010202202 [0,1,0,0,0,1|2,0,0]=4 2386 B13R2.5179 Oc1cnc2c(cccc2c1)Br 271570a_203496583355_100010204298 [0,1,0,0,0,1|2,0,0]=4 2387 B13R2.5179 Oc1cnc2c(cccc2c1)Cl 271570a_203496583355_100000759377 [0,1,0,0,0,1|2,0,0]=4 2388 B13R2.5179 Oc1cnc2c(cccc2c1)F 271570a_203496583355_100000049890 [0,1,0,0,0,1|2,0,0]=4 2389 B13R2.45 C=Cc1sc2ccccc2c1C 271570a_100011290941_200010198769 [0,2,0,0,0,0|0,1,1]=4 2390 B13R2.45 CNc1nc2ccccc2n1C 27a_100102657272_200000239431 [0,2,0,0,0,0|2,0,0]=4 2391 B13R2.45 COc1cc2ccccc2n1C 34a_100000066695_200000210301 [0,2,0,0,0,0|1,0,0]=3 2392 B13R2.45 CSC1Cc2ccccc2C1=O 62a_100011218503_200000210301 [0,2,0,0,0,0|1,0,1]=4 2393 B13R2.45 CSC1Cc2ccccc2C1=O 62a_200000210301_100011218503 [0,2,0,0,0,0|1,0,1]=4 2394 B13R2.45 CSc1nc2ccccc2n1C 62a_200000210301_200000239431 [0,2,0,0,0,0|2,0,0]=4 2395 B13R2.45 CSc1nc2ccccc2n1C 62a_200000239431_200000210301 [0,2,0,0,0,0|2,0,0]=4 2396 B13R2.45 CSc1sc2ccccc2c1Br 62a_100015504031_200000210301 [0,2,0,0,0,0|0,1,0]=3 2397 B13R2.45 CSc1sc2ccccc2c1Br 62a_200000210301_100015504031 [0,2,0,0,0,0|0,1,0]=3 2398 B13R2.45 CSc1sc2ccccc2c1C 62a_200000210301_200010198769 [0,2,0,0,0,0|0,1,0]=3 2399 B13R2.45 Cc1c(sc2c1cccc2)S[13CH3] 62a_200025704644_200010198769 [0,2,0,0,0,0|0,1,0]=3 2400 B13R2.45 Cn1c(cc2c1cccc2)O[13CH3] 34a_100000066695_200025704644 [0,2,0,0,0,0|1,0,0]=3 2401 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200000239431_200025704644 [0,2,0,0,0,0|2,0,0]=4 2402 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200025704644_200000239431 [0,2,0,0,0,0|2,0,0]=4 2403 B13R2.45 O=Cc1sc2ccccc2c1O 271570a_203496583355_100009816528 [0,2,0,0,0,0|0,1,1]=4 2404 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_100011218503_200025704644 [0,2,0,0,0,0|1,0,1]=4 2405 B13R2.45 [13CH3]SC1Cc2ccccc2C1=O 62a_200025704644_100011218503 [0,2,0,0,0,0|1,0,1]=4 2406 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_100015504031_200025704644 [0,2,0,0,0,0|0,1,0]=3 2407 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_200025704644_100015504031 [0,2,0,0,0,0|0,1,0]=3 2408 B13R2.135 C=Cc1c(nc2n1cccc2)C 271570a_100011290941_100009816614 [0,2,0,0,0,0|2,0,0]=4 2409 B13R2.135 C=Cc1c(oc2c1cccc2)C 271570a_100011290941_200010236113 [0,2,0,0,0,0|0,0,0]=2 2410 B13R2.135 C=Cc1c(sc2c1cccc2)C 271570a_100011290941_100010002616 [0,2,0,0,0,0|0,1,0]=3 2411 B13R2.135 C=Cc1c2ccccc2nn1C 271570a_100011290941_100010163699 [0,2,0,0,0,0|2,0,0]=4 2412 B13R2.135 CSc1c([nH]c2c1cccn2)C 62a_200000210301_100010174266 [0,2,0,0,0,0|2,0,0]=4 2413 B13R2.135 CSc1c(nc2n1cccc2)C 62a_100000762796_200000210301 [0,2,0,0,0,0|2,0,0]=4 2414 B13R2.135 CSc1c(nc2n1cccc2)C 62a_200000210301_100000762796 [0,2,0,0,0,0|2,0,0]=4 2415 B13R2.135 CSc1c(oc2c1cccc2)C 62a_200000210301_200010236113 [0,2,0,0,0,0|0,0,0]=2 2416 B13R2.135 CSc1c(sc2c1cccc2)C 62a_100010002616_200000210301 [0,2,0,0,0,0|0,1,0]=3 2417 B13R2.135 CSc1c(sc2c1cccc2)C 62a_200000210301_100010002616 [0,2,0,0,0,0|0,1,0]=3 2418 B13R2.135 CSc1c2ccccc2nn1C 62a_100010163699_200000210301 [0,2,0,0,0,0|2,0,0]=4 2419 B13R2.135 CSc1c2ccccc2nn1C 62a_200000210301_100010163699 [0,2,0,0,0,0|2,0,0]=4 2420 B13R2.135 Cc1[nH]c2ncccc2c1S[13CH3] 62a_200025704644_100010174266 [0,2,0,0,0,0|2,0,0]=4 2421 B13R2.135 Cc1nc2ccccn2c1S[13CH3] 62a_100000762796_200025704644 [0,2,0,0,0,0|2,0,0]=4 2422 B13R2.135 Cc1nc2ccccn2c1S[13CH3] 62a_200025704644_100000762796 [0,2,0,0,0,0|2,0,0]=4 2423 B13R2.135 Cc1oc2ccccc2c1S[13CH3] 62a_200025704644_200010236113 [0,2,0,0,0,0|0,0,0]=2 2424 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_100010002616_200025704644 [0,2,0,0,0,0|0,1,0]=3 2425 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_200025704644_100010002616 [0,2,0,0,0,0|0,1,0]=3 2426 B13R2.135 Cn1nc2ccccc2c1S[13CH3] 62a_100010163699_200025704644 [0,2,0,0,0,0|2,0,0]=4 2427 B13R2.135 Cn1nc2ccccc2c1S[13CH3] 62a_200025704644_100010163699 [0,2,0,0,0,0|2,0,0]=4 2428 B13R2.3028 CC1Cc2ccc(cc2C1=O)O 271570a_203496583355_100000694082 [0,2,0,0,0,0|1,0,1]=4 2429 B13R2.3028 CN1Cc2ccc(cc2C1=O)O 271570a_203496583355_100010125600 [0,2,0,0,0,0|2,0,0]=4 2430 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,2,0,0,0,0|1,0,0]=3 2431 B13R2.3028 Cc1c2cc(ccc2nn1C)O 271570a_203496583355_100009817121 [0,2,0,0,0,0|2,0,0]=4 2432 B13R2.3028 Cc1nc2ccc(cc2n1C)O 271570a_203496583355_200010218347 [0,2,0,0,0,0|2,0,0]=4 2433 B13R2.3028 Cc1nc2ccc(cn2c1N)O 271570a_203496583355_200011888355 [0,2,0,0,0,0|2,0,0]=4 2434 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [0,2,0,0,0,0|2,0,0]=4 2435 B13R2.4825 CC1Cc2c(cccc2C1=O)O 271570a_203496583355_200012356775 [0,2,0,0,0,0|1,0,1]=4 2436 B13R2.4825 CN1Cc2c(cccc2C1=O)O 271570a_203496583355_100009817108 [0,2,0,0,0,0|2,0,0]=4 2437 B13R2.4825 Cc1c2cccc(c2nn1C)O 271570a_203496583355_100010255105 [0,2,0,0,0,0|2,0,0]=4 2438 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,2,0,0,0,0|2,0,0]=4 2439 B13R2.4856 Cc1[nH]c2nccc(c2c1C)O 271570a_203496583355_206744597382 [0,2,0,0,0,0|2,0,0]=4 2440 B13R2.4856 O=C1Nc2cccc(c2C1=O)O 271570a_203496583355_100000697038 [0,2,0,0,0,0|2,0,0]=4 2441 B13R2.5190 CC1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010169280 [0,2,0,0,0,0|1,0,1]=4 2442 B13R2.5190 CN1Cc2cc(ccc2C1=O)O 271570a_203496583355_100010161043 [0,2,0,0,0,0|2,0,0]=4 2443 B13R2.5190 Cc1c2ccc(cc2nn1C)O 271570a_203496583355_100010247116 [0,2,0,0,0,0|2,0,0]=4 2444 B13R2.5190 Cc1nc2cc(ccc2n1C)O 271570a_203496583355_100000729442 [0,2,0,0,0,0|2,0,0]=4 2445 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,2,0,0,0,0|2,0,0]=4 2446 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,2,0,0,0,0|2,0,0]=4 2447 B13R2.26 C=C=Cc1cc2ccccc2[nH]1 271570a_100015277604_100010232065 [0,2,0,0,0,0|1,0,1]=4 2448 B13R2.26 C=C=Cc1cc2ccccc2o1 271570a_100015277604_100010159458 [0,2,0,0,0,0|0,0,1]=3 2449 B13R2.26 C=C=Cc1cc2ccccc2s1 271570a_100015277604_100009816949 [0,2,0,0,0,0|0,1,1]=4 2450 B13R2.26 CC=Cc1cc2ccccc2[nH]1 271570a_100016259895_100010232065 [0,2,0,0,0,0|1,0,0]=3 2451 B13R2.26 CC=Cc1cc2ccccc2o1 271570a_100016259895_100010159458 [0,2,0,0,0,0|0,0,0]=2 2452 B13R2.26 CC=Cc1cc2ccccc2s1 271570a_100016259895_100009816949 [0,2,0,0,0,0|0,1,0]=3 2453 B13R2.26 CC=Cc1cc2cccnc2[nH]1 271570a_100016259895_100010079843 [0,2,0,0,0,0|2,0,0]=4 2454 B13R2.26 CC=Cc1cn2ccccc2n1 271570a_100016259895_100009819586 [0,2,0,0,0,0|2,0,0]=4 2455 B13R2.26 CC=Cc1nc2ccccc2[nH]1 271570a_100016259895_100009814255 [0,2,0,0,0,0|2,0,0]=4 2456 B13R2.26 CC=Cc1nc2ccccc2s1 271570a_100016259895_100000751744 [0,2,0,0,0,0|1,1,0]=4 2457 B13R2.26 CCNc1nc2ccccc2[nH]1 27a_100015525214_100009814255 [0,2,0,0,0,0|2,0,0]=4 2458 B13R2.26 CCNc1nc2ccccc2s1 27a_100015525214_100000751744 [0,2,0,0,0,0|1,1,0]=4 2459 B13R2.26 CCSc1cc2ccccc2[nH]1 62a_100000210202_100010232065 [0,2,0,0,0,0|1,0,0]=3 2460 B13R2.26 CCSc1cc2ccccc2o1 62a_100000210202_100010159458 [0,2,0,0,0,0|0,0,0]=2 2461 B13R2.26 CCSc1cc2ccccc2s1 62a_100000210202_100009816949 [0,2,0,0,0,0|0,1,0]=3 2462 B13R2.26 CCSc1cc2cccnc2[nH]1 62a_100000210202_100010079843 [0,2,0,0,0,0|2,0,0]=4 2463 B13R2.26 CCSc1cn2ccccc2n1 62a_100000210202_100009819586 [0,2,0,0,0,0|2,0,0]=4 2464 B13R2.26 CCSc1nc2ccccc2[nH]1 62a_100000210202_100009814255 [0,2,0,0,0,0|2,0,0]=4 2465 B13R2.26 CCSc1nc2ccccc2s1 62a_100000210202_100000751744 [0,2,0,0,0,0|1,1,0]=4 2466 B13R2.26 CNCC1Cc2ccccc2O1 2230a_100015207006_200000210301 [0,2,0,0,0,0|0,0,2]=4 2467 B13R2.26 CNCC1Cc2ccccc2O1 34a_100015207006_200000210301 [0,2,0,0,0,0|0,0,2]=4 2468 B13R2.26 CNCc1cc2ccccc2[nH]1 270004a_106832991635_100000051030 [0,2,0,0,0,0|1,0,0]=3 2469 B13R2.26 CNCc1cc2ccccc2o1 207a_100102657272_100000229944 [0,2,0,0,0,0|0,0,0]=2 2470 B13R2.26 CNCc1cc2ccccc2o1 270004a_106832991635_100000229944 [0,2,0,0,0,0|0,0,0]=2 2471 B13R2.26 CNCc1cc2ccccc2s1 207a_100102657272_100000686906 [0,2,0,0,0,0|0,1,0]=3 2472 B13R2.26 CNCc1cc2ccccc2s1 2230a_100015187092_200000210301 [0,2,0,0,0,0|0,1,0]=3 2473 B13R2.26 CNCc1cc2ccccc2s1 270004a_106832991635_100000686906 [0,2,0,0,0,0|0,1,0]=3 2474 B13R2.26 CNCc1cc2cccnc2[nH]1 207a_100102657272_100000088027 [0,2,0,0,0,0|2,0,0]=4 2475 B13R2.26 CNCc1cc2cccnc2[nH]1 270004a_106832991635_100000088027 [0,2,0,0,0,0|2,0,0]=4 2476 B13R2.26 CNCc1cc2cccnc2s1 207a_100102657272_100000050461 [0,2,0,0,0,0|1,1,0]=4 2477 B13R2.26 CNCc1cc2cccnc2s1 270004a_106832991635_100000050461 [0,2,0,0,0,0|1,1,0]=4 2478 B13R2.26 CNCc1cc2ccncc2[nH]1 270004a_106832991635_200000084276 [0,2,0,0,0,0|2,0,0]=4 2479 B13R2.26 CNCc1cc2cnccc2o1 207a_100102657272_100009860033 [0,2,0,0,0,0|1,0,0]=3 2480 B13R2.26 CNCc1cc2cnccc2o1 270004a_106832991635_100009860033 [0,2,0,0,0,0|1,0,0]=3 2481 B13R2.26 CNCc1cc2cnccc2s1 207a_100102657272_100000054438 [0,2,0,0,0,0|1,1,0]=4 2482 B13R2.26 CNCc1cc2cnccc2s1 270004a_106832991635_100000054438 [0,2,0,0,0,0|1,1,0]=4 2483 B13R2.26 CNCc1cc2ncccc2o1 207a_100102657272_100000104172 [0,2,0,0,0,0|1,0,0]=3 2484 B13R2.26 CNCc1cc2ncccc2o1 270004a_106832991635_100000104172 [0,2,0,0,0,0|1,0,0]=3 2485 B13R2.26 CNCc1cn2ccccc2n1 207a_100102657272_100000743146 [0,2,0,0,0,0|2,0,0]=4 2486 B13R2.26 CNCc1cn2ccccc2n1 2230a_106832991635_100000689847 [0,2,0,0,0,0|2,0,0]=4 2487 B13R2.26 CNCc1cn2ccccc2n1 34a_100102657272_100000689847 [0,2,0,0,0,0|2,0,0]=4 2488 B13R2.26 CNCc1cn2ccccc2n1 7a_106832991635_100000689847 [0,2,0,0,0,0|2,0,0]=4 2489 B13R2.26 CNCc1nc2ccccc2[nH]1 207a_100102657272_100000185668 [0,2,0,0,0,0|2,0,0]=4 2490 B13R2.26 CNCc1nc2ccccc2[nH]1 2230a_106832991635_100000737899 [0,2,0,0,0,0|2,0,0]=4 2491 B13R2.26 CNCc1nc2ccccc2[nH]1 270004a_106832991635_100000185668 [0,2,0,0,0,0|2,0,0]=4 2492 B13R2.26 CNCc1nc2ccccc2[nH]1 7a_106832991635_100000737899 [0,2,0,0,0,0|2,0,0]=4 2493 B13R2.26 CNCc1nc2ccccc2o1 2230a_106832991635_100000195508 [0,2,0,0,0,0|1,0,0]=3 2494 B13R2.26 CNCc1nc2ccccc2o1 34a_100102657272_200012361514 [0,2,0,0,0,0|1,0,0]=3 2495 B13R2.26 CNCc1nc2ccccc2o1 7a_106832991635_100000195508 [0,2,0,0,0,0|1,0,0]=3 2496 B13R2.26 CNCc1nc2ccccc2s1 2230a_106832991635_100000766747 [0,2,0,0,0,0|1,1,0]=4 2497 B13R2.26 CNCc1nc2ccccc2s1 270004a_106832991635_100011204187 [0,2,0,0,0,0|1,1,0]=4 2498 B13R2.26 CNCc1nc2ccccc2s1 34a_100102657272_100011217541 [0,2,0,0,0,0|1,1,0]=4 2499 B13R2.26 CNCc1nc2ccccc2s1 7a_106832991635_100011217541 [0,2,0,0,0,0|1,1,0]=4 2500 B13R2.26 CNCc1nc2ncccc2o1 2230a_106832991635_100000696355 [0,2,0,0,0,0|2,0,0]=4 2501 B13R2.26 CNCc1nc2ncccc2o1 7a_106832991635_100000696355 [0,2,0,0,0,0|2,0,0]=4 2502 B13R2.26 COCC1Cc2ccccc2O1 34a_100011273944_200000210301 [0,2,0,0,0,0|0,0,2]=4 2503 B13R2.26 COCc1cc2ccccc2o1 34a_100000233474_200000210301 [0,2,0,0,0,0|0,0,0]=2 2504 B13R2.26 COCc1cc2ccccc2o1 7a_100000233474_200000210301 [0,2,0,0,0,0|0,0,0]=2 2505 B13R2.26 COCc1cn2ccccc2n1 34a_100138415774_100000689847 [0,2,0,0,0,0|2,0,0]=4 2506 B13R2.26 COCc1nc2ccccc2o1 34a_100138415774_200012361514 [0,2,0,0,0,0|1,0,0]=3 2507 B13R2.26 COCc1nc2ccccc2s1 34a_100138415774_100011217541 [0,2,0,0,0,0|1,1,0]=4 2508 B13R2.26 CSCc1cn2ccccc2n1 62a_100000689847_200000210301 [0,2,0,0,0,0|2,0,0]=4 2509 B13R2.26 CSCc1cn2ccccc2n1 62a_200000210301_100000689847 [0,2,0,0,0,0|2,0,0]=4 2510 B13R2.26 CSCc1nc2ccccc2[nH]1 62a_200000210301_100000737899 [0,2,0,0,0,0|2,0,0]=4 2511 B13R2.26 CSCc1nc2ccccc2o1 62a_200000210301_100000195508 [0,2,0,0,0,0|1,0,0]=3 2512 B13R2.26 CSCc1nc2ccccc2s1 62a_100011217541_200000210301 [0,2,0,0,0,0|1,1,0]=4 2513 B13R2.26 CSCc1nc2ccccc2s1 62a_200000210301_100000766747 [0,2,0,0,0,0|1,1,0]=4 2514 B13R2.26 CSCc1nc2ncccc2o1 62a_200000210301_100000696355 [0,2,0,0,0,0|2,0,0]=4 2515 B13R2.26 FCSc1cc2ccccc2[nH]1 62a_100015361967_100010232065 [0,2,0,0,0,0|1,0,0]=3 2516 B13R2.26 FCSc1cc2ccccc2o1 62a_100015361967_100010159458 [0,2,0,0,0,0|0,0,0]=2 2517 B13R2.26 FCSc1cc2ccccc2s1 62a_100015361967_100009816949 [0,2,0,0,0,0|0,1,0]=3 2518 B13R2.26 FCSc1cc2cccnc2[nH]1 62a_100015361967_100010079843 [0,2,0,0,0,0|2,0,0]=4 2519 B13R2.26 FCSc1cn2ccccc2n1 62a_100015361967_100009819586 [0,2,0,0,0,0|2,0,0]=4 2520 B13R2.26 FCSc1nc2ccccc2[nH]1 62a_100015361967_100009814255 [0,2,0,0,0,0|2,0,0]=4 2521 B13R2.26 FCSc1nc2ccccc2s1 62a_100015361967_100000751744 [0,2,0,0,0,0|1,1,0]=4 2522 B13R2.26 [13CH3]NCC1Cc2ccccc2O1 2230a_100015207006_200025704644 [0,2,0,0,0,0|0,0,2]=4 2523 B13R2.26 [13CH3]NCC1Cc2ccccc2O1 34a_100015207006_200025704644 [0,2,0,0,0,0|0,0,2]=4 2524 B13R2.26 [13CH3]NCc1cc2ccccc2s1 2230a_100015187092_200025704644 [0,2,0,0,0,0|0,1,0]=3 2525 B13R2.26 [13CH3]OCC1Cc2ccccc2O1 34a_100011273944_200025704644 [0,2,0,0,0,0|0,0,2]=4 2526 B13R2.26 [13CH3]OCc1cc2ccccc2o1 34a_100000233474_200025704644 [0,2,0,0,0,0|0,0,0]=2 2527 B13R2.26 [13CH3]OCc1cc2ccccc2o1 7a_100000233474_200025704644 [0,2,0,0,0,0|0,0,0]=2 2528 B13R2.26 [13CH3]SCc1cn2ccccc2n1 62a_100000689847_200025704644 [0,2,0,0,0,0|2,0,0]=4 2529 B13R2.26 [13CH3]SCc1cn2ccccc2n1 62a_200025704644_100000689847 [0,2,0,0,0,0|2,0,0]=4 2530 B13R2.26 [13CH3]SCc1nc2ccccc2[nH]1 62a_200025704644_100000737899 [0,2,0,0,0,0|2,0,0]=4 2531 B13R2.26 [13CH3]SCc1nc2ccccc2o1 62a_200025704644_100000195508 [0,2,0,0,0,0|1,0,0]=3 2532 B13R2.26 [13CH3]SCc1nc2ccccc2s1 62a_100011217541_200025704644 [0,2,0,0,0,0|1,1,0]=4 2533 B13R2.26 [13CH3]SCc1nc2ccccc2s1 62a_200025704644_100000766747 [0,2,0,0,0,0|1,1,0]=4 2534 B13R2.26 [13CH3]SCc1nc2ncccc2o1 62a_200025704644_100000696355 [0,2,0,0,0,0|2,0,0]=4 2535 B13R2.43 C=Cc1cc2cc(ccc2[nH]1)Br 271570a_100011290941_100011012855 [0,2,0,0,0,0|1,0,1]=4 2536 B13R2.43 C=Cc1cc2cc(ccc2s1)Br 271570a_100011290941_200010198765 [0,2,0,0,0,0|0,1,1]=4 2537 B13R2.43 CCc1cc2cc(ccc2o1)O 271570a_203496583355_200010233821 [0,2,0,0,0,0|0,0,0]=2 2538 B13R2.43 CCc1nc2cc(ccc2o1)O 271570a_203496583355_100009817032 [0,2,0,0,0,0|1,0,0]=3 2539 B13R2.43 CCn1cc2cc(ccc2n1)O 271570a_203496583355_200010157581 [0,2,0,0,0,0|2,0,0]=4 2540 B13R2.43 CNc1nc2cc(ccc2s1)F 27a_100102657272_200010206605 [0,2,0,0,0,0|1,1,0]=4 2541 B13R2.43 CNc1nc2cc(ccc2s1)N 27a_100102657272_100010329861 [0,2,0,0,0,0|1,1,0]=4 2542 B13R2.43 CNc1nc2ccc(cc2s1)C 27a_100102657272_100010186437 [0,2,0,0,0,0|1,1,0]=4 2543 B13R2.43 CNc1nc2ccc(cc2s1)F 27a_100102657272_100000751617 [0,2,0,0,0,0|1,1,0]=4 2544 B13R2.43 CNc1nc2ccc(cc2s1)N 27a_100102657272_100010253933 [0,2,0,0,0,0|1,1,0]=4 2545 B13R2.43 CNc1nc2ccc(cc2s1)O 271570a_203496583355_100012351673 [0,2,0,0,0,0|1,1,0]=4 2546 B13R2.43 CNc1nc2ccc(cc2s1)O 27a_100102657272_100010063415 [0,2,0,0,0,0|1,1,0]=4 2547 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200000210301 [0,2,0,0,0,0|1,0,0]=3 2548 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_200000210301_100011012855 [0,2,0,0,0,0|1,0,0]=3 2549 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200000210301_200010198765 [0,2,0,0,0,0|0,1,0]=3 2550 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200010198765_200000210301 [0,2,0,0,0,0|0,1,0]=3 2551 B13R2.43 CSc1cn2cc(ccc2n1)F 62a_100010231931_200000210301 [0,2,0,0,0,0|2,0,0]=4 2552 B13R2.43 CSc1cn2cc(ccc2n1)F 62a_200000210301_100010231931 [0,2,0,0,0,0|2,0,0]=4 2553 B13R2.43 CSc1nc2cc(ccc2s1)F 62a_200000210301_200010206605 [0,2,0,0,0,0|1,1,0]=4 2554 B13R2.43 CSc1nc2cc(ccc2s1)F 62a_200010206605_200000210301 [0,2,0,0,0,0|1,1,0]=4 2555 B13R2.43 CSc1nc2cc(ccc2s1)N 62a_100010329861_200000210301 [0,2,0,0,0,0|1,1,0]=4 2556 B13R2.43 CSc1nc2cc(ccc2s1)N 62a_200000210301_100010329861 [0,2,0,0,0,0|1,1,0]=4 2557 B13R2.43 CSc1nc2cc(ccc2s1)O 271570a_203496583355_200010003198 [0,2,0,0,0,0|1,1,0]=4 2558 B13R2.43 CSc1nc2ccc(cc2s1)C 62a_200000210301_100010186437 [0,2,0,0,0,0|1,1,0]=4 2559 B13R2.43 CSc1nc2ccc(cc2s1)F 62a_100000751617_200000210301 [0,2,0,0,0,0|1,1,0]=4 2560 B13R2.43 CSc1nc2ccc(cc2s1)F 62a_200000210301_100000751617 [0,2,0,0,0,0|1,1,0]=4 2561 B13R2.43 CSc1nc2ccc(cc2s1)N 62a_100010253933_200000210301 [0,2,0,0,0,0|1,1,0]=4 2562 B13R2.43 CSc1nc2ccc(cc2s1)N 62a_200000210301_100010253933 [0,2,0,0,0,0|1,1,0]=4 2563 B13R2.43 CSc1nc2ccc(cc2s1)O 271570a_203496583355_100010193624 [0,2,0,0,0,0|1,1,0]=4 2564 B13R2.43 CSc1nc2ccc(cc2s1)O 62a_200000210301_100010063415 [0,2,0,0,0,0|1,1,0]=4 2565 B13R2.43 Cc1ccc2nc(sc2c1)S[13CH3] 62a_200025704644_100010186437 [0,2,0,0,0,0|1,1,0]=4 2566 B13R2.43 N#Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100010261159 [0,2,0,0,0,0|1,0,1]=4 2567 B13R2.43 N#Cc1cc2cc(ccc2s1)O 271570a_203496583355_200010238524 [0,2,0,0,0,0|0,1,1]=4 2568 B13R2.43 N#Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010739539 [0,2,0,0,0,0|1,0,1]=4 2569 B13R2.43 O=Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009820874 [0,2,0,0,0,0|1,0,1]=4 2570 B13R2.43 O=Cc1cc2cc(ccc2o1)O 271570a_203496583355_100000755920 [0,2,0,0,0,0|0,0,1]=3 2571 B13R2.43 O=Cc1cc2cc(ccc2s1)O 271570a_203496583355_100010238522 [0,2,0,0,0,0|0,1,1]=4 2572 B13R2.43 O=Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000736022 [0,2,0,0,0,0|1,0,1]=4 2573 B13R2.43 O=Cc1cc2ccc(cc2s1)O 271570a_203496583355_100009814784 [0,2,0,0,0,0|0,1,1]=4 2574 B13R2.43 OCc1cc2cc(ccc2o1)O 271570a_203496583355_100011934623 [0,2,0,0,0,0|0,0,0]=2 2575 B13R2.43 OCc1cc2cc(ccc2s1)O 271570a_203496583355_100010255381 [0,2,0,0,0,0|0,1,0]=3 2576 B13R2.43 OCc1cc2cc(ncc2[nH]1)O 271570a_203496583355_100010549619 [0,2,0,0,0,0|2,0,0]=4 2577 B13R2.43 OCc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000735881 [0,2,0,0,0,0|1,0,0]=3 2578 B13R2.43 OCc1cc2ccc(cc2s1)O 271570a_203496583355_100010244134 [0,2,0,0,0,0|0,1,0]=3 2579 B13R2.43 OCc1cc2nc(ccc2o1)O 271570a_203496583355_100000732455 [0,2,0,0,0,0|1,0,0]=3 2580 B13R2.43 OCc1cn2cc(ccc2n1)O 271570a_203496583355_100010211410 [0,2,0,0,0,0|2,0,0]=4 2581 B13R2.43 OCc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000698547 [0,2,0,0,0,0|2,0,0]=4 2582 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200025704644 [0,2,0,0,0,0|1,0,0]=3 2583 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_200025704644_100011012855 [0,2,0,0,0,0|1,0,0]=3 2584 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200010198765_200025704644 [0,2,0,0,0,0|0,1,0]=3 2585 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200025704644_200010198765 [0,2,0,0,0,0|0,1,0]=3 2586 B13R2.43 [13CH3]Sc1cn2cc(ccc2n1)F 62a_100010231931_200025704644 [0,2,0,0,0,0|2,0,0]=4 2587 B13R2.43 [13CH3]Sc1cn2cc(ccc2n1)F 62a_200025704644_100010231931 [0,2,0,0,0,0|2,0,0]=4 2588 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)F 62a_200010206605_200025704644 [0,2,0,0,0,0|1,1,0]=4 2589 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)F 62a_200025704644_200010206605 [0,2,0,0,0,0|1,1,0]=4 2590 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)N 62a_100010329861_200025704644 [0,2,0,0,0,0|1,1,0]=4 2591 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)N 62a_200025704644_100010329861 [0,2,0,0,0,0|1,1,0]=4 2592 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)F 62a_100000751617_200025704644 [0,2,0,0,0,0|1,1,0]=4 2593 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)F 62a_200025704644_100000751617 [0,2,0,0,0,0|1,1,0]=4 2594 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)N 62a_100010253933_200025704644 [0,2,0,0,0,0|1,1,0]=4 2595 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)N 62a_200025704644_100010253933 [0,2,0,0,0,0|1,1,0]=4 2596 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)O 62a_200025704644_100010063415 [0,2,0,0,0,0|1,1,0]=4 2597 B13R2.54 C=Cc1cc2cccc(c2[nH]1)Br 271570a_100011290941_100135389745 [0,2,0,0,0,0|1,0,1]=4 2598 B13R2.54 CNc1nc2c(cccc2s1)C 27a_100102657272_100010008827 [0,2,0,0,0,0|1,1,0]=4 2599 B13R2.54 CNc1nc2c(cccc2s1)F 27a_100102657272_100010008856 [0,2,0,0,0,0|1,1,0]=4 2600 B13R2.54 CSc1cc2c(ccnc2[nH]1)Cl 62a_200000210301_100010234028 [0,2,0,0,0,0|2,0,0]=4 2601 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_100135389745_200000210301 [0,2,0,0,0,0|1,0,0]=3 2602 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_200000210301_100135389745 [0,2,0,0,0,0|1,0,0]=3 2603 B13R2.54 CSc1cc2nccc(c2s1)Cl 62a_200000210301_100010192579 [0,2,0,0,0,0|1,1,0]=4 2604 B13R2.54 CSc1nc2c(cccc2s1)C 62a_200000210301_100010008827 [0,2,0,0,0,0|1,1,0]=4 2605 B13R2.54 CSc1nc2c(cccc2s1)F 62a_200000210301_100010008856 [0,2,0,0,0,0|1,1,0]=4 2606 B13R2.54 Cc1cccc2c1nc(s2)S[13CH3] 62a_200025704644_100010008827 [0,2,0,0,0,0|1,1,0]=4 2607 B13R2.54 N#Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010174851 [0,2,0,0,0,0|1,0,1]=4 2608 B13R2.54 O=Cc1cc2c(cccc2s1)O 271570a_203496583355_100010109917 [0,2,0,0,0,0|0,1,1]=4 2609 B13R2.54 O=Cc1cc2cccc(c2s1)O 271570a_203496583355_100010110135 [0,2,0,0,0,0|0,1,1]=4 2610 B13R2.54 OCC1Cc2cccc(c2O1)O 271570a_203496583355_200102525175 [0,2,0,0,0,0|0,0,2]=4 2611 B13R2.54 OCc1cc2c(cncc2s1)O 271570a_203496583355_200010168114 [0,2,0,0,0,0|1,1,0]=4 2612 B13R2.54 OCc1cc2cccc(c2s1)O 271570a_203496583355_100010255382 [0,2,0,0,0,0|0,1,0]=3 2613 B13R2.54 [13CH3]Sc1cc2c(ccnc2[nH]1)Cl 62a_200025704644_100010234028 [0,2,0,0,0,0|2,0,0]=4 2614 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_100135389745_200025704644 [0,2,0,0,0,0|1,0,0]=3 2615 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_200025704644_100135389745 [0,2,0,0,0,0|1,0,0]=3 2616 B13R2.54 [13CH3]Sc1cc2nccc(c2s1)Cl 62a_200025704644_100010192579 [0,2,0,0,0,0|1,1,0]=4 2617 B13R2.54 [13CH3]Sc1nc2c(cccc2s1)F 62a_200025704644_100010008856 [0,2,0,0,0,0|1,1,0]=4 2618 B13R2.435 C=C(C)c1cc2ccccc2[nH]1 271570a_100000694244_100010232065 [0,2,0,0,0,0|1,0,0]=3 2619 B13R2.435 C=C(C)c1cc2ccccc2o1 271570a_100000694244_100010159458 [0,2,0,0,0,0|0,0,0]=2 2620 B13R2.435 C=C(C)c1cc2ccccc2s1 271570a_100000694244_100009816949 [0,2,0,0,0,0|0,1,0]=3 2621 B13R2.435 C=C(C)c1cc2cccnc2[nH]1 271570a_100000694244_100010079843 [0,2,0,0,0,0|2,0,0]=4 2622 B13R2.435 C=C(C)c1cn2ccccc2n1 271570a_100000694244_100009819586 [0,2,0,0,0,0|2,0,0]=4 2623 B13R2.435 C=C(C)c1nc2ccccc2[nH]1 271570a_100000694244_100009814255 [0,2,0,0,0,0|2,0,0]=4 2624 B13R2.435 C=C(C)c1nc2ccccc2s1 271570a_100000694244_100000751744 [0,2,0,0,0,0|1,1,0]=4 2625 B13R2.435 CC(=O)C1=Cc2ccccc2C1 1458a_100009862756_200000210301 [0,2,0,0,0,0|1,0,0]=3 2626 B13R2.435 CC(=O)C1Cc2ccccc2O1 1458a_100000209886_200000210301 [0,2,0,0,0,0|0,0,2]=4 2627 B13R2.435 CN(C)c1nc2ccccc2[nH]1 27a_100102631434_100009814255 [0,2,0,0,0,0|2,0,0]=4 2628 B13R2.435 CN(C)c1nc2ccccc2s1 27a_100102631434_100000751744 [0,2,0,0,0,0|1,1,0]=4 2629 B13R2.435 [13CH3]C(=O)C1=Cc2ccccc2C1 1458a_100009862756_200025704644 [0,2,0,0,0,0|1,0,0]=3 2630 B13R2.435 [13CH3]C(=O)C1Cc2ccccc2O1 1458a_100000209886_200025704644 [0,2,0,0,0,0|0,0,2]=4 2631 B13R2.3051 CC1(Oc2ccc(cc2O1)O)C 271570a_203496583355_100010187540 [0,2,0,0,0,0|1,0,1]=4 2632 B13R2.4826 CC1(Cc2cccc(c2O1)O)C 271570a_203496583355_100000741280 [0,2,0,0,0,0|0,0,2]=4 2633 B13R2.581 C=Cc1cccc2c1CC(=C2)C 271570a_100011290941_100010271545 [0,2,0,0,0,0|1,0,0]=3 2634 B13R2.581 C=Cc1cccc2c1cc([nH]2)C 271570a_100011290941_100010143266 [0,2,0,0,0,0|1,0,0]=3 2635 B13R2.581 C=Cc1cccc2c1cn(n2)C 271570a_100011290941_100009817162 [0,2,0,0,0,0|2,0,0]=4 2636 B13R2.581 C=Cc1cccc2c1nc([nH]2)C 271570a_100011290941_100012360556 [0,2,0,0,0,0|2,0,0]=4 2637 B13R2.581 C=Cc1cccc2c1nc(o2)C 271570a_100011290941_100010883239 [0,2,0,0,0,0|1,0,0]=3 2638 B13R2.581 C=Cc1cccc2c1nc(s2)C 271570a_100011290941_100010236672 [0,2,0,0,0,0|1,1,0]=4 2639 B13R2.581 C=Cc1cccc2c1nn(c2)C 271570a_100011290941_100009817170 [0,2,0,0,0,0|2,0,0]=4 2640 B13R2.581 C=Cc1cccc2c1oc(=O)[nH]2 271570a_100011290941_100012360093 [0,2,0,0,0,0|2,0,0]=4 2641 B13R2.581 C=Cc1cccc2c1oc(n2)C 271570a_100011290941_100010168998 [0,2,0,0,0,0|1,0,0]=3 2642 B13R2.581 C=Cc1cccc2c1oc(n2)N 271570a_100011290941_100012347120 [0,2,0,0,0,0|2,0,0]=4 2643 B13R2.581 C=Cc1cccc2c1sc(c2)N 271570a_100011290941_100010090802 [0,2,0,0,0,0|1,1,0]=4 2644 B13R2.581 C=Cc1cccc2c1sc(n2)C 271570a_100011290941_100010236699 [0,2,0,0,0,0|1,1,0]=4 2645 B13R2.581 C=Cc1cccc2n1cc(n2)C 271570a_100011290941_100009817088 [0,2,0,0,0,0|2,0,0]=4 2646 B13R2.581 C=Cc1ccnc2c1cc([nH]2)C 271570a_100011290941_100010202352 [0,2,0,0,0,0|2,0,0]=4 2647 B13R2.581 C=Cc1cncc2c1oc(n2)C 271570a_100011290941_100010197357 [0,2,0,0,0,0|2,0,0]=4 2648 B13R2.581 CC1=Cc2cccc(c2C1)S[13CH3] 62a_100010271545_200025704644 [0,2,0,0,0,0|1,0,0]=3 2649 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 2230a_100000124160_200025704644 [0,2,0,0,0,0|0,0,2]=4 2650 B13R2.581 CC1Cc2cccc(c2O1)N[13CH3] 34a_100000124160_200025704644 [0,2,0,0,0,0|0,0,2]=4 2651 B13R2.581 CNc1cccc2c1OC(C2)C 2230a_100000124160_200000210301 [0,2,0,0,0,0|0,0,2]=4 2652 B13R2.581 CNc1cccc2c1OC(C2)C 34a_100000124160_200000210301 [0,2,0,0,0,0|0,0,2]=4 2653 B13R2.581 CNc1cccc2c1cn(n2)C 34a_100000070539_200000210301 [0,2,0,0,0,0|2,0,0]=4 2654 B13R2.581 CNc1cccc2c1nc(o2)C 34a_100011934982_200000210301 [0,2,0,0,0,0|1,0,0]=3 2655 B13R2.581 CNc1cccc2c1nn(c2)C 34a_103496549576_200000210301 [0,2,0,0,0,0|2,0,0]=4 2656 B13R2.581 CNc1cccc2c1oc(c2)C 34a_200015185323_200000210301 [0,2,0,0,0,0|0,0,0]=2 2657 B13R2.581 CNc1cncc2c1oc(n2)C 27a_100102657272_100010197357 [0,2,0,0,0,0|2,0,0]=4 2658 B13R2.581 COc1cccc2c1cc([nH]2)C 34a_200000059750_200000210301 [0,2,0,0,0,0|1,0,0]=3 2659 B13R2.581 COc1cccc2c1cn(n2)C 34a_100000106842_200000210301 [0,2,0,0,0,0|2,0,0]=4 2660 B13R2.581 COc1cccc2c1nc(o2)N 7a_100009892541_200000210301 [0,2,0,0,0,0|2,0,0]=4 2661 B13R2.581 COc1cccn2c1nc(c2)C 34a_100000017037_200000210301 [0,2,0,0,0,0|2,0,0]=4 2662 B13R2.581 CSc1cccc2c1CC(=C2)C 62a_100010271545_200000210301 [0,2,0,0,0,0|1,0,0]=3 2663 B13R2.581 CSc1cccc2c1cc([nH]2)C 62a_200000210301_100010143266 [0,2,0,0,0,0|1,0,0]=3 2664 B13R2.581 CSc1cccc2c1cn(n2)C 62a_100009817162_200000210301 [0,2,0,0,0,0|2,0,0]=4 2665 B13R2.581 CSc1cccc2c1cn(n2)C 62a_200000210301_100009817162 [0,2,0,0,0,0|2,0,0]=4 2666 B13R2.581 CSc1cccc2c1nc([nH]2)C 62a_200000210301_100012360556 [0,2,0,0,0,0|2,0,0]=4 2667 B13R2.581 CSc1cccc2c1nc(o2)C 62a_200000210301_100010883239 [0,2,0,0,0,0|1,0,0]=3 2668 B13R2.581 CSc1cccc2c1nc(s2)C 62a_100010236672_200000210301 [0,2,0,0,0,0|1,1,0]=4 2669 B13R2.581 CSc1cccc2c1nc(s2)C 62a_200000210301_100010236672 [0,2,0,0,0,0|1,1,0]=4 2670 B13R2.581 CSc1cccc2c1nn(c2)C 62a_200000210301_100009817170 [0,2,0,0,0,0|2,0,0]=4 2671 B13R2.581 CSc1cccc2c1oc(n2)C 62a_200000210301_100010168998 [0,2,0,0,0,0|1,0,0]=3 2672 B13R2.581 CSc1cccc2c1sc(c2)N 62a_100010090802_200000210301 [0,2,0,0,0,0|1,1,0]=4 2673 B13R2.581 CSc1cccc2c1sc(n2)C 62a_100010236699_200000210301 [0,2,0,0,0,0|1,1,0]=4 2674 B13R2.581 CSc1cccc2c1sc(n2)C 62a_200000210301_100010236699 [0,2,0,0,0,0|1,1,0]=4 2675 B13R2.581 CSc1cccc2n1cc(n2)C 62a_100009817088_200000210301 [0,2,0,0,0,0|2,0,0]=4 2676 B13R2.581 CSc1cccc2n1cc(n2)C 62a_200000210301_100009817088 [0,2,0,0,0,0|2,0,0]=4 2677 B13R2.581 CSc1ccnc2c1cc([nH]2)C 62a_200000210301_100010202352 [0,2,0,0,0,0|2,0,0]=4 2678 B13R2.581 CSc1cncc2c1oc(n2)C 62a_200000210301_100010197357 [0,2,0,0,0,0|2,0,0]=4 2679 B13R2.581 Cc1cc2c(cccc2[nH]1)O[13CH3] 34a_200000059750_200025704644 [0,2,0,0,0,0|1,0,0]=3 2680 B13R2.581 Cc1cc2c(cccc2[nH]1)S[13CH3] 62a_200025704644_100010143266 [0,2,0,0,0,0|1,0,0]=3 2681 B13R2.581 Cc1cc2c(ccnc2[nH]1)S[13CH3] 62a_200025704644_100010202352 [0,2,0,0,0,0|2,0,0]=4 2682 B13R2.581 Cc1cc2cccc(c2o1)N[13CH3] 34a_200015185323_200025704644 [0,2,0,0,0,0|0,0,0]=2 2683 B13R2.581 Cc1cn2c(cccc2n1)S[13CH3] 62a_100009817088_200025704644 [0,2,0,0,0,0|2,0,0]=4 2684 B13R2.581 Cc1cn2c(cccc2n1)S[13CH3] 62a_200025704644_100009817088 [0,2,0,0,0,0|2,0,0]=4 2685 B13R2.581 Cc1cn2cccc(c2n1)O[13CH3] 34a_100000017037_200025704644 [0,2,0,0,0,0|2,0,0]=4 2686 B13R2.581 Cc1nc2c(cccc2[nH]1)S[13CH3] 62a_200025704644_100012360556 [0,2,0,0,0,0|2,0,0]=4 2687 B13R2.581 Cc1nc2c(cccc2o1)N[13CH3] 34a_100011934982_200025704644 [0,2,0,0,0,0|1,0,0]=3 2688 B13R2.581 Cc1nc2c(cccc2o1)S[13CH3] 62a_200025704644_100010883239 [0,2,0,0,0,0|1,0,0]=3 2689 B13R2.581 Cc1nc2c(cccc2s1)S[13CH3] 62a_100010236672_200025704644 [0,2,0,0,0,0|1,1,0]=4 2690 B13R2.581 Cc1nc2c(cccc2s1)S[13CH3] 62a_200025704644_100010236672 [0,2,0,0,0,0|1,1,0]=4 2691 B13R2.581 Cc1nc2cccc(c2o1)S[13CH3] 62a_200025704644_100010168998 [0,2,0,0,0,0|1,0,0]=3 2692 B13R2.581 Cc1nc2cccc(c2s1)S[13CH3] 62a_100010236699_200025704644 [0,2,0,0,0,0|1,1,0]=4 2693 B13R2.581 Cc1nc2cccc(c2s1)S[13CH3] 62a_200025704644_100010236699 [0,2,0,0,0,0|1,1,0]=4 2694 B13R2.581 Cc1nc2cncc(c2o1)S[13CH3] 62a_200025704644_100010197357 [0,2,0,0,0,0|2,0,0]=4 2695 B13R2.581 Cn1cc2c(cccc2n1)N[13CH3] 34a_100000070539_200025704644 [0,2,0,0,0,0|2,0,0]=4 2696 B13R2.581 Cn1cc2c(cccc2n1)O[13CH3] 34a_100000106842_200025704644 [0,2,0,0,0,0|2,0,0]=4 2697 B13R2.581 Cn1cc2c(cccc2n1)S[13CH3] 62a_100009817162_200025704644 [0,2,0,0,0,0|2,0,0]=4 2698 B13R2.581 Cn1cc2c(cccc2n1)S[13CH3] 62a_200025704644_100009817162 [0,2,0,0,0,0|2,0,0]=4 2699 B13R2.581 Cn1cc2cccc(c2n1)N[13CH3] 34a_103496549576_200025704644 [0,2,0,0,0,0|2,0,0]=4 2700 B13R2.581 Cn1cc2cccc(c2n1)S[13CH3] 62a_200025704644_100009817170 [0,2,0,0,0,0|2,0,0]=4 2701 B13R2.581 [13CH3]Oc1cccc2c1nc(o2)N 7a_100009892541_200025704644 [0,2,0,0,0,0|2,0,0]=4 2702 B13R2.581 [13CH3]Sc1cccc2c1sc(c2)N 62a_100010090802_200025704644 [0,2,0,0,0,0|1,1,0]=4 2703 B13R2.3050 Cc1c(ccc2c1cn(n2)C)O 271570a_203496583355_100010255100 [0,2,0,0,0,0|2,0,0]=4 2704 B13R2.3050 Cc1ccc2nn(cc2c1O)C 271570a_203496583355_100010255097 [0,2,0,0,0,0|2,0,0]=4 2705 B13R2.3050 Cc1cn2ccc(c(c2n1)Cl)O 271570a_203496583355_100010870584 [0,2,0,0,0,0|2,0,0]=4 2706 B13R2.3050 Cn1cc2c(c(ccc2n1)F)O 271570a_203496583355_206772885649 [0,2,0,0,0,0|2,0,0]=4 2707 B13R2.5397 Cc1cc(cc2c1nn(c2)C)O 271570a_203496583355_100010255102 [0,2,0,0,0,0|2,0,0]=4 2708 B13R2.5397 Cc1cn2cc(cc(c2n1)F)O 271570a_203496583355_100010892224 [0,2,0,0,0,0|2,0,0]=4 2709 B13R2.5397 Cc1nc2c(cc(cc2s1)O)F 271570a_203496583355_100000719245 [0,2,0,0,0,0|1,1,0]=4 2710 B13R2.2121 C=Cc1ccc2[nH]c(=O)oc2c1 271570a_100011290941_100000697996 [0,2,0,0,0,0|2,0,0]=4 2711 B13R2.2121 C=Cc1ccc2[nH]c(cc2c1)C 271570a_100011290941_100011214893 [0,2,0,0,0,0|1,0,0]=3 2712 B13R2.2121 C=Cc1ccc2[nH]c(nc2c1)C 271570a_100011290941_100011264012 [0,2,0,0,0,0|2,0,0]=4 2713 B13R2.2121 C=Cc1ccc2cc([nH]c2c1)C 271570a_100011290941_100010196937 [0,2,0,0,0,0|1,0,0]=3 2714 B13R2.2121 C=Cc1ccc2cn(nc2c1)C 271570a_100011290941_100009817169 [0,2,0,0,0,0|2,0,0]=4 2715 B13R2.2121 C=Cc1ccc2nc(cn2c1)C 271570a_100011290941_100000194050 [0,2,0,0,0,0|2,0,0]=4 2716 B13R2.2121 C=Cc1ccc2nc(oc2c1)C 271570a_100011290941_100010171164 [0,2,0,0,0,0|1,0,0]=3 2717 B13R2.2121 C=Cc1ccc2nc(oc2c1)N 271570a_100011290941_100010000678 [0,2,0,0,0,0|2,0,0]=4 2718 B13R2.2121 C=Cc1ccc2nc(sc2c1)C 271570a_100011290941_100009813144 [0,2,0,0,0,0|1,1,0]=4 2719 B13R2.2121 C=Cc1ccc2nn(cc2c1)C 271570a_100011290941_100009817163 [0,2,0,0,0,0|2,0,0]=4 2720 B13R2.2121 C=Cc1ccc2oc(=O)[nH]c2c1 271570a_100011290941_100000764829 [0,2,0,0,0,0|2,0,0]=4 2721 B13R2.2121 C=Cc1ccc2oc(nc2c1)C 271570a_100011290941_100009816932 [0,2,0,0,0,0|1,0,0]=3 2722 B13R2.2121 C=Cc1ccc2oc(nc2c1)N 271570a_100011290941_100000737949 [0,2,0,0,0,0|2,0,0]=4 2723 B13R2.2121 C=Cc1ccc2sc(cc2c1)C 271570a_100011290941_100000695401 [0,2,0,0,0,0|0,1,0]=3 2724 B13R2.2121 C=Cc1ccc2sc(nc2c1)C 271570a_100011290941_100009813953 [0,2,0,0,0,0|1,1,0]=4 2725 B13R2.2121 C=Cc1ccn2cc(nc2c1)C 271570a_100011290941_100000724326 [0,2,0,0,0,0|2,0,0]=4 2726 B13R2.2121 C=Cc1cnc2[nH]c(cc2c1)C 271570a_100011290941_100010202332 [0,2,0,0,0,0|2,0,0]=4 2727 B13R2.2121 C=Cc1cnc2cc([nH]c2c1)C 271570a_100011290941_100010168555 [0,2,0,0,0,0|2,0,0]=4 2728 B13R2.2121 C=Cc1cnc2nc(oc2c1)C 271570a_100011290941_100010235748 [0,2,0,0,0,0|2,0,0]=4 2729 B13R2.2121 C=Cc1cnc2oc(nc2c1)C 271570a_100011290941_100010178690 [0,2,0,0,0,0|2,0,0]=4 2730 B13R2.2121 CC1Cc2cc(ccc2O1)N[13CH3] 2230a_100102713350_200025704644 [0,2,0,0,0,0|0,0,2]=4 2731 B13R2.2121 CC1Cc2cc(ccc2O1)N[13CH3] 34a_100102713350_200025704644 [0,2,0,0,0,0|0,0,2]=4 2732 B13R2.2121 CNc1ccc2c(c1)CC(O2)C 2230a_100102713350_200000210301 [0,2,0,0,0,0|0,0,2]=4 2733 B13R2.2121 CNc1ccc2c(c1)CC(O2)C 34a_100102713350_200000210301 [0,2,0,0,0,0|0,0,2]=4 2734 B13R2.2121 CNc1ccc2cn(nc2c1)C 34a_100000066241_200000210301 [0,2,0,0,0,0|2,0,0]=4 2735 B13R2.2121 CNc1ccc2nc(oc2c1)C 34a_100000736495_200000210301 [0,2,0,0,0,0|1,0,0]=3 2736 B13R2.2121 CNc1ccc2nn(cc2c1)C 34a_100000067545_200000210301 [0,2,0,0,0,0|2,0,0]=4 2737 B13R2.2121 CNc1ccc2oc(nc2c1)C 34a_100000195416_200000210301 [0,2,0,0,0,0|1,0,0]=3 2738 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [0,2,0,0,0,0|2,0,0]=4 2739 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,2,0,0,0,0|1,0,0]=3 2740 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,2,0,0,0,0|1,0,0]=3 2741 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 34a_100000035078_200000210301 [0,2,0,0,0,0|1,0,1]=4 2742 B13R2.2121 COc1ccc2c(c1)CC(=O)O2 7a_100000035078_200000210301 [0,2,0,0,0,0|1,0,1]=4 2743 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,2,0,0,0,0|1,0,0]=3 2744 B13R2.2121 COc1ccc2cc(oc2c1)C 34a_100000095638_200000210301 [0,2,0,0,0,0|0,0,0]=2 2745 B13R2.2121 COc1ccc2cc(oc2c1)C 7a_100000095638_200000210301 [0,2,0,0,0,0|0,0,0]=2 2746 B13R2.2121 COc1ccc2nc(oc2c1)C 34a_100000116946_200000210301 [0,2,0,0,0,0|1,0,0]=3 2747 B13R2.2121 COc1ccc2nc(oc2c1)C 7a_100000116946_200000210301 [0,2,0,0,0,0|1,0,0]=3 2748 B13R2.2121 COc1ccc2nc(sc2c1)C 34a_100000008955_200000210301 [0,2,0,0,0,0|1,1,0]=4 2749 B13R2.2121 COc1ccc2nc(sc2c1)C 7a_100000008955_200000210301 [0,2,0,0,0,0|1,1,0]=4 2750 B13R2.2121 COc1ccc2nn(cc2c1)C 34a_100000106843_200000210301 [0,2,0,0,0,0|2,0,0]=4 2751 B13R2.2121 COc1ccc2oc(nc2c1)C 34a_100000102623_200000210301 [0,2,0,0,0,0|1,0,0]=3 2752 B13R2.2121 COc1ccc2oc(nc2c1)C 7a_100000102623_200000210301 [0,2,0,0,0,0|1,0,0]=3 2753 B13R2.2121 COc1ccc2oc(nc2c1)Cl 34a_100010673232_200000210301 [0,2,0,0,0,0|2,0,0]=4 2754 B13R2.2121 COc1ccc2oc(nc2c1)Cl 7a_100010673232_200000210301 [0,2,0,0,0,0|2,0,0]=4 2755 B13R2.2121 COc1ccc2sc(nc2c1)C 34a_100000031546_200000210301 [0,2,0,0,0,0|1,1,0]=4 2756 B13R2.2121 COc1ccc2sc(nc2c1)C 7a_100000031546_200000210301 [0,2,0,0,0,0|1,1,0]=4 2757 B13R2.2121 COc1ccn2cc(nc2c1)C 34a_106256048495_200000210301 [0,2,0,0,0,0|2,0,0]=4 2758 B13R2.2121 CSc1ccc2[nH]c(=O)oc2c1 62a_200000210301_100000697996 [0,2,0,0,0,0|2,0,0]=4 2759 B13R2.2121 CSc1ccc2[nH]c(cc2c1)C 62a_200000210301_100011214893 [0,2,0,0,0,0|1,0,0]=3 2760 B13R2.2121 CSc1ccc2[nH]c(nc2c1)C 62a_200000210301_100011264012 [0,2,0,0,0,0|2,0,0]=4 2761 B13R2.2121 CSc1ccc2cc([nH]c2c1)C 62a_200000210301_100010196937 [0,2,0,0,0,0|1,0,0]=3 2762 B13R2.2121 CSc1ccc2cn(nc2c1)C 62a_200000210301_100009817169 [0,2,0,0,0,0|2,0,0]=4 2763 B13R2.2121 CSc1ccc2nc(cn2c1)C 62a_100000194050_200000210301 [0,2,0,0,0,0|2,0,0]=4 2764 B13R2.2121 CSc1ccc2nc(cn2c1)C 62a_200000210301_100000194050 [0,2,0,0,0,0|2,0,0]=4 2765 B13R2.2121 CSc1ccc2nc(oc2c1)C 62a_200000210301_100010171164 [0,2,0,0,0,0|1,0,0]=3 2766 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_100009813144_200000210301 [0,2,0,0,0,0|1,1,0]=4 2767 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_200000210301_100009813144 [0,2,0,0,0,0|1,1,0]=4 2768 B13R2.2121 CSc1ccc2nn(cc2c1)C 62a_100009817163_200000210301 [0,2,0,0,0,0|2,0,0]=4 2769 B13R2.2121 CSc1ccc2nn(cc2c1)C 62a_200000210301_100009817163 [0,2,0,0,0,0|2,0,0]=4 2770 B13R2.2121 CSc1ccc2oc(nc2c1)C 62a_200000210301_100009816932 [0,2,0,0,0,0|1,0,0]=3 2771 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_100000695401_200000210301 [0,2,0,0,0,0|0,1,0]=3 2772 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_200000210301_100000695401 [0,2,0,0,0,0|0,1,0]=3 2773 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_100009813953_200000210301 [0,2,0,0,0,0|1,1,0]=4 2774 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_200000210301_100009813953 [0,2,0,0,0,0|1,1,0]=4 2775 B13R2.2121 CSc1ccn2cc(nc2c1)C 62a_100000724326_200000210301 [0,2,0,0,0,0|2,0,0]=4 2776 B13R2.2121 CSc1ccn2cc(nc2c1)C 62a_200000210301_100000724326 [0,2,0,0,0,0|2,0,0]=4 2777 B13R2.2121 CSc1cnc2[nH]c(cc2c1)C 62a_200000210301_100010202332 [0,2,0,0,0,0|2,0,0]=4 2778 B13R2.2121 CSc1cnc2cc([nH]c2c1)C 62a_200000210301_100010168555 [0,2,0,0,0,0|2,0,0]=4 2779 B13R2.2121 CSc1cnc2nc(oc2c1)C 62a_100010235748_200000210301 [0,2,0,0,0,0|2,0,0]=4 2780 B13R2.2121 CSc1cnc2nc(oc2c1)C 62a_200000210301_100010235748 [0,2,0,0,0,0|2,0,0]=4 2781 B13R2.2121 CSc1cnc2oc(nc2c1)C 62a_200000210301_100010178690 [0,2,0,0,0,0|2,0,0]=4 2782 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,2,0,0,0,0|1,0,0]=3 2783 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,2,0,0,0,0|1,0,0]=3 2784 B13R2.2121 Cc1cc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011214893 [0,2,0,0,0,0|1,0,0]=3 2785 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_100000695401_200025704644 [0,2,0,0,0,0|0,1,0]=3 2786 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_200025704644_100000695401 [0,2,0,0,0,0|0,1,0]=3 2787 B13R2.2121 Cc1cc2cc(cnc2[nH]1)S[13CH3] 62a_200025704644_100010202332 [0,2,0,0,0,0|2,0,0]=4 2788 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,2,0,0,0,0|1,0,0]=3 2789 B13R2.2121 Cc1cc2ccc(cc2[nH]1)S[13CH3] 62a_200025704644_100010196937 [0,2,0,0,0,0|1,0,0]=3 2790 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 34a_100000095638_200025704644 [0,2,0,0,0,0|0,0,0]=2 2791 B13R2.2121 Cc1cc2ccc(cc2o1)O[13CH3] 7a_100000095638_200025704644 [0,2,0,0,0,0|0,0,0]=2 2792 B13R2.2121 Cc1cc2ncc(cc2[nH]1)S[13CH3] 62a_200025704644_100010168555 [0,2,0,0,0,0|2,0,0]=4 2793 B13R2.2121 Cc1cn2cc(ccc2n1)S[13CH3] 62a_100000194050_200025704644 [0,2,0,0,0,0|2,0,0]=4 2794 B13R2.2121 Cc1cn2cc(ccc2n1)S[13CH3] 62a_200025704644_100000194050 [0,2,0,0,0,0|2,0,0]=4 2795 B13R2.2121 Cc1cn2ccc(cc2n1)O[13CH3] 34a_106256048495_200025704644 [0,2,0,0,0,0|2,0,0]=4 2796 B13R2.2121 Cc1cn2ccc(cc2n1)S[13CH3] 62a_100000724326_200025704644 [0,2,0,0,0,0|2,0,0]=4 2797 B13R2.2121 Cc1cn2ccc(cc2n1)S[13CH3] 62a_200025704644_100000724326 [0,2,0,0,0,0|2,0,0]=4 2798 B13R2.2121 Cc1nc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011264012 [0,2,0,0,0,0|2,0,0]=4 2799 B13R2.2121 Cc1nc2cc(ccc2o1)N[13CH3] 34a_100000195416_200025704644 [0,2,0,0,0,0|1,0,0]=3 2800 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 34a_100000102623_200025704644 [0,2,0,0,0,0|1,0,0]=3 2801 B13R2.2121 Cc1nc2cc(ccc2o1)O[13CH3] 7a_100000102623_200025704644 [0,2,0,0,0,0|1,0,0]=3 2802 B13R2.2121 Cc1nc2cc(ccc2o1)S[13CH3] 62a_200025704644_100009816932 [0,2,0,0,0,0|1,0,0]=3 2803 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 34a_100000031546_200025704644 [0,2,0,0,0,0|1,1,0]=4 2804 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 7a_100000031546_200025704644 [0,2,0,0,0,0|1,1,0]=4 2805 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_100009813953_200025704644 [0,2,0,0,0,0|1,1,0]=4 2806 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_200025704644_100009813953 [0,2,0,0,0,0|1,1,0]=4 2807 B13R2.2121 Cc1nc2cc(cnc2o1)S[13CH3] 62a_200025704644_100010178690 [0,2,0,0,0,0|2,0,0]=4 2808 B13R2.2121 Cc1nc2ccc(cc2o1)N[13CH3] 34a_100000736495_200025704644 [0,2,0,0,0,0|1,0,0]=3 2809 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 34a_100000116946_200025704644 [0,2,0,0,0,0|1,0,0]=3 2810 B13R2.2121 Cc1nc2ccc(cc2o1)O[13CH3] 7a_100000116946_200025704644 [0,2,0,0,0,0|1,0,0]=3 2811 B13R2.2121 Cc1nc2ccc(cc2o1)S[13CH3] 62a_200025704644_100010171164 [0,2,0,0,0,0|1,0,0]=3 2812 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 34a_100000008955_200025704644 [0,2,0,0,0,0|1,1,0]=4 2813 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 7a_100000008955_200025704644 [0,2,0,0,0,0|1,1,0]=4 2814 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_100009813144_200025704644 [0,2,0,0,0,0|1,1,0]=4 2815 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_200025704644_100009813144 [0,2,0,0,0,0|1,1,0]=4 2816 B13R2.2121 Cc1nc2ncc(cc2o1)S[13CH3] 62a_100010235748_200025704644 [0,2,0,0,0,0|2,0,0]=4 2817 B13R2.2121 Cc1nc2ncc(cc2o1)S[13CH3] 62a_200025704644_100010235748 [0,2,0,0,0,0|2,0,0]=4 2818 B13R2.2121 Cn1cc2cc(ccc2n1)N[13CH3] 34a_100000067545_200025704644 [0,2,0,0,0,0|2,0,0]=4 2819 B13R2.2121 Cn1cc2cc(ccc2n1)O[13CH3] 34a_100000106843_200025704644 [0,2,0,0,0,0|2,0,0]=4 2820 B13R2.2121 Cn1cc2cc(ccc2n1)S[13CH3] 62a_100009817163_200025704644 [0,2,0,0,0,0|2,0,0]=4 2821 B13R2.2121 Cn1cc2cc(ccc2n1)S[13CH3] 62a_200025704644_100009817163 [0,2,0,0,0,0|2,0,0]=4 2822 B13R2.2121 Cn1cc2ccc(cc2n1)N[13CH3] 34a_100000066241_200025704644 [0,2,0,0,0,0|2,0,0]=4 2823 B13R2.2121 Cn1cc2ccc(cc2n1)S[13CH3] 62a_200025704644_100009817169 [0,2,0,0,0,0|2,0,0]=4 2824 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [0,2,0,0,0,0|2,0,0]=4 2825 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 34a_100000035078_200025704644 [0,2,0,0,0,0|1,0,1]=4 2826 B13R2.2121 [13CH3]Oc1ccc2c(c1)CC(=O)O2 7a_100000035078_200025704644 [0,2,0,0,0,0|1,0,1]=4 2827 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 34a_100010673232_200025704644 [0,2,0,0,0,0|2,0,0]=4 2828 B13R2.2121 [13CH3]Oc1ccc2oc(nc2c1)Cl 7a_100010673232_200025704644 [0,2,0,0,0,0|2,0,0]=4 2829 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)oc2c1 62a_200025704644_100000697996 [0,2,0,0,0,0|2,0,0]=4 2830 B13R2.13083 Cc1cc2cc(c(cc2[nH]1)F)O 271570a_203496583355_200010763346 [0,2,0,0,0,0|1,0,0]=3 2831 B13R2.13083 Cc1cc2cn(nc2cc1O)C 271570a_203496583355_100010255104 [0,2,0,0,0,0|2,0,0]=4 2832 B13R2.13083 Cc1cc2nn(cc2cc1O)C 271570a_203496583355_100010255101 [0,2,0,0,0,0|2,0,0]=4 2833 B13R2.13083 Cc1nc2cc(c(cc2[nH]1)F)O 271570a_203496583355_100000733457 [0,2,0,0,0,0|2,0,0]=4 2834 B13R2.13083 Cc1nc2cc(c(cc2s1)O)C 271570a_203496583355_200010762721 [0,2,0,0,0,0|1,1,0]=4 2835 B13R2.13083 Cn1cc2cc(c(cc2n1)F)O 271570a_203496583355_100021298661 [0,2,0,0,0,0|2,0,0]=4 2836 B13R2.13083 Cn1cc2cc(c(cc2n1)O)F 271570a_203496583355_100010131895 [0,2,0,0,0,0|2,0,0]=4 2837 B13R2.13083 Cn1cc2cc(c(cc2n1)O)O 271570a_203496583355_100010742938 [0,2,0,0,0,0|2,0,0]=4 2838 B9R0.18 C=CC=CC(=O)C/C=C/C 1458a_100016291481_100102629194 [0,0,2,0,0,0|0,0,2]=4 2839 B9R0.18 C=CC=CC(=O)CC=CC 1458a_100016291481_100000070051 [0,0,2,0,0,0|0,0,2]=4 2840 B9R0.4 C=CC=CC(=O)CC(=C)C 1458a_100016291481_100000748629 [0,0,2,0,0,0|2,0,0]=4 2841 B11R2.55 Oc1ccccc1C2CC2 271570a_100011220607_100000739446 [0,0,1,1,0,0|0,0,2]=4 2842 B11R2.55 Oc1ccccc1C2CC2 271570a_203496583355_100009819954 [0,0,1,1,0,0|0,0,2]=4 2843 B11R2.238 c1ccc(cc1)OC2CC2 34a_100000210340_100000211595 [0,0,1,1,0,0|0,0,2]=4 2844 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [0,0,1,0,1,0|0,0,0]=2 2845 B9R1.6 C=C(C)c1ccccn1 271570a_100000694244_100011216584 [0,0,1,0,1,0|1,0,0]=3 2846 B9R1.6 C=C(C)c1cccnc1 271570a_100000694244_100000752921 [0,0,1,0,1,0|1,0,0]=3 2847 B9R1.6 C=C(C)c1cccnn1 271570a_100000694244_100016991348 [0,0,1,0,1,0|2,0,0]=4 2848 B9R1.6 C=C(C)c1ccncc1 271570a_100000694244_100000035832 [0,0,1,0,1,0|1,0,0]=3 2849 B9R1.6 C=C(C)c1ccncn1 271570a_100000694244_100000703185 [0,0,1,0,1,0|2,0,0]=4 2850 B9R1.6 C=C(C)c1ccnnc1 271570a_100000694244_100000732662 [0,0,1,0,1,0|2,0,0]=4 2851 B9R1.6 C=C(C)c1cnccn1 271570a_100000694244_100000758340 [0,0,1,0,1,0|2,0,0]=4 2852 B9R1.6 C=C(C)c1cncnc1 271570a_100000694244_100011206942 [0,0,1,0,1,0|2,0,0]=4 2853 B9R1.6 C=C(C)c1ncccn1 271570a_100000694244_100000211032 [0,0,1,0,1,0|2,0,0]=4 2854 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [0,0,1,0,1,0|0,0,1]=3 2855 B9R1.6 CN(C)c1ccccc1 2230a_100000210012_200000210301 [0,0,1,0,1,0|1,0,1]=4 2856 B9R1.6 CN(C)c1ccccc1 269982a_100000210012_200000210301 [0,0,1,0,1,0|1,0,1]=4 2857 B9R1.6 CN(C)c1ccccc1 34a_100000210012_200000210301 [0,0,1,0,1,0|1,0,1]=4 2858 B9R1.6 CN([13CH3])c1ccccc1 2230a_100000210012_200025704644 [0,0,1,0,1,0|1,0,1]=4 2859 B9R1.6 CN([13CH3])c1ccccc1 269982a_100000210012_200025704644 [0,0,1,0,1,0|1,0,1]=4 2860 B9R1.6 CN([13CH3])c1ccccc1 34a_100000210012_200025704644 [0,0,1,0,1,0|1,0,1]=4 2861 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [0,0,1,0,1,0|0,0,1]=3 2862 B9R1.13 CC(=Cc1ccco1)C 271570a_100102525489_100009814098 [0,0,1,0,1,0|2,0,0]=4 2863 B9R1.13 CC(=Cc1cccs1)C 271570a_100102525489_100011215356 [0,0,1,0,1,0|2,0,0]=4 2864 B9R1.13 CC(=Cc1ccoc1)C 271570a_100102525489_100011215275 [0,0,1,0,1,0|2,0,0]=4 2865 B9R1.13 CC(=Cc1ccsc1)C 271570a_100102525489_100000738268 [0,0,1,0,1,0|2,0,0]=4 2866 B11R1.5 CCOc1cccccc1=O 34a_100000036025_100000210202 [0,0,1,0,0,1|1,0,1]=4 2867 B11R1.5 CCOc1cccccc1=O 7a_100000036025_100000210202 [0,0,1,0,0,1|1,0,1]=4 2868 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [0,0,1,0,0,1|1,0,0]=3 2869 B11R1.91 C=C(C)COc1ccccc1 34a_100000210340_100000748629 [0,0,1,0,0,1|0,0,0]=2 2870 B11R1.91 C=C(C)COc1ccccc1 7a_100000210340_100000748629 [0,0,1,0,0,1|0,0,0]=2 2871 B11R1.91 C=C(C)COc1cccnc1 34a_100000210849_100000748629 [0,0,1,0,0,1|1,0,0]=3 2872 B11R1.91 C=C(C)COc1cccnc1 7a_100000210849_100000748629 [0,0,1,0,0,1|1,0,0]=3 2873 B11R1.91 C=C(C)COc1ccncc1 34a_100000212176_100000748629 [0,0,1,0,0,1|1,0,0]=3 2874 B11R1.91 C=C(C)COc1ccnnc1 34a_100015204005_100000748629 [0,0,1,0,0,1|2,0,0]=4 2875 B11R1.91 C=C(C)COc1cncnc1 7a_100000754086_100000748629 [0,0,1,0,0,1|2,0,0]=4 2876 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [0,0,1,0,0,1|0,1,0]=3 2877 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [0,0,1,0,0,1|0,1,0]=3 2878 B11R1.91 C=C(C)CSc1ccccn1 62a_100000748629_100011216584 [0,0,1,0,0,1|1,1,0]=4 2879 B11R1.91 C=C(C)CSc1ccccn1 62a_100011216584_100000211660 [0,0,1,0,0,1|1,1,0]=4 2880 B11R1.91 C=C(C)CSc1cccnc1 62a_100000210063_100000211660 [0,0,1,0,0,1|1,1,0]=4 2881 B11R1.91 C=C(C)CSc1cccnc1 62a_100000748629_100000210063 [0,0,1,0,0,1|1,1,0]=4 2882 B11R1.91 C=C(C)CSc1ccncc1 62a_100000728582_100000211660 [0,0,1,0,0,1|1,1,0]=4 2883 B11R1.91 C=C(C)CSc1ccncc1 62a_100000748629_100000728582 [0,0,1,0,0,1|1,1,0]=4 2884 B11R1.91 C=C(F)CNc1ccccc1 34a_100000106764_100009893438 [0,0,1,0,0,1|2,0,0]=4 2885 B11R1.91 C=C(F)COc1ccccc1 34a_100000210340_100009893438 [0,0,1,0,0,1|1,0,0]=3 2886 B11R1.91 C=C(F)COc1ccccc1 7a_100000210340_100000042424 [0,0,1,0,0,1|1,0,0]=3 2887 B11R1.91 C=C(F)COc1cccnc1 34a_100000210849_100009893438 [0,0,1,0,0,1|2,0,0]=4 2888 B11R1.91 C=C(F)COc1cccnc1 7a_100000210849_100000042424 [0,0,1,0,0,1|2,0,0]=4 2889 B11R1.91 C=C(F)COc1ccncc1 34a_100000212176_100009893438 [0,0,1,0,0,1|2,0,0]=4 2890 B11R1.91 C=C(F)CSc1ccccc1 62a_100000042424_100000041952 [0,0,1,0,0,1|1,1,0]=4 2891 B11R1.91 C=C(F)CSc1ccccc1 62a_100000719477_100000042424 [0,0,1,0,0,1|1,1,0]=4 2892 B11R1.91 CC(=O)C#Cc1ccccc1 1458a_100000736102_200000210301 [0,0,1,0,0,1|0,0,2]=4 2893 B11R1.91 CC(=O)C=Cc1ccccc1 1458a_100000210462_200000210301 [0,0,1,0,0,1|0,0,1]=3 2894 B11R1.91 CC(=O)C=Cc1ccccn1 1458a_100000740811_200000210301 [0,0,1,0,0,1|1,0,1]=4 2895 B11R1.91 CC(=O)C=Cc1cccnc1 1458a_100000735890_200000210301 [0,0,1,0,0,1|1,0,1]=4 2896 B11R1.91 CC(=O)C=Cc1ccncc1 1458a_100000682801_200000210301 [0,0,1,0,0,1|1,0,1]=4 2897 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000070787_100000765856 [0,0,1,0,0,1|0,0,2]=4 2898 B11R1.91 CC(=O)CCc1ccccc1 1458a_100000185753_200000210301 [0,0,1,0,0,1|0,0,2]=4 2899 B11R1.91 CC(=O)COc1ccccc1 1458a_100000186222_200000210301 [0,0,1,0,0,1|1,0,0]=3 2900 B11R1.91 CC(=O)COc1ccccn1 1458a_100102699861_200000210301 [0,0,1,0,0,1|2,0,0]=4 2901 B11R1.91 CC(=O)COc1cccnc1 1458a_100015207166_200000210301 [0,0,1,0,0,1|2,0,0]=4 2902 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,0,1,0,0,1|0,0,2]=4 2903 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,0,1,0,0,1|0,0,2]=4 2904 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,0,1,0,0,1|0,0,2]=4 2905 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,0,1,0,0,1|0,0,2]=4 2906 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,0,1,0,0,1|0,0,2]=4 2907 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [0,0,1,0,0,1|1,0,1]=4 2908 B11R1.91 CC(C)C=Cc1ccccc1 271570a_100016257149_100000210277 [0,0,1,0,0,1|1,0,1]=4 2909 B11R1.91 CC(C)COc1ccccc1 34a_100000210340_100000210624 [0,0,1,0,0,1|0,0,2]=4 2910 B11R1.91 CC(C)COc1ccccc1 7a_100000210340_100000210760 [0,0,1,0,0,1|0,0,2]=4 2911 B11R1.91 CC(C)OCc1ccccc1 34a_100000210790_100000210206 [0,0,1,0,0,1|0,0,2]=4 2912 B11R1.91 CC(C)OCc1ccccc1 34a_100000212225_100015291786 [0,0,1,0,0,1|0,0,2]=4 2913 B11R1.91 CC(C)OCc1ccccc1 7a_100000210790_100000210206 [0,0,1,0,0,1|0,0,2]=4 2914 B11R1.91 CC(O)C=Cc1ccccc1 271570a_200011019289_100000210277 [0,0,1,0,0,1|0,0,1]=3 2915 B11R1.91 CC(O)C=Cc1ccccn1 271570a_200011019289_100011216584 [0,0,1,0,0,1|1,0,1]=4 2916 B11R1.91 CC(O)C=Cc1cccnc1 271570a_200011019289_100000752921 [0,0,1,0,0,1|1,0,1]=4 2917 B11R1.91 CC(O)C=Cc1ccncc1 271570a_200011019289_100000035832 [0,0,1,0,0,1|1,0,1]=4 2918 B11R1.91 CC(O)CNc1ccccc1 34a_100000106764_100011218427 [0,0,1,0,0,1|0,0,2]=4 2919 B11R1.91 CC(O)COc1ccccc1 34a_100000210340_100011218427 [0,0,1,0,0,1|0,0,2]=4 2920 B11R1.91 CC(O)COc1ccccc1 7a_100000210340_100011218427 [0,0,1,0,0,1|0,0,2]=4 2921 B11R1.91 CC(O)CSc1ccccc1 62a_100000719477_100011218427 [0,0,1,0,0,1|0,0,2]=4 2922 B11R1.91 CC(O)CSc1ccccc1 62a_100011218427_100000041952 [0,0,1,0,0,1|0,0,2]=4 2923 B11R1.91 C[C@@H](O)CNc1ccccc1 34a_100000106764_100009817552 [0,0,1,0,0,1|0,0,2]=4 2924 B11R1.91 C[C@@H](O)COc1ccccc1 34a_100000210340_100009817552 [0,0,1,0,0,1|0,0,2]=4 2925 B11R1.91 C[C@@H](O)COc1ccccc1 7a_100000210340_100009817552 [0,0,1,0,0,1|0,0,2]=4 2926 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100000719477_100009817552 [0,0,1,0,0,1|0,0,2]=4 2927 B11R1.91 C[C@@H](O)CSc1ccccc1 62a_100009817552_100000041952 [0,0,1,0,0,1|0,0,2]=4 2928 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,0,1,0,0,1|2,0,0]=4 2929 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,0,1,0,0,1|2,0,0]=4 2930 B11R1.91 O=C([O-])COc1ccccc1 34a_100000210340_100020667443 [0,0,1,0,0,1|2,0,0]=4 2931 B11R1.91 [13CH3]C(=O)C#Cc1ccccc1 1458a_100000736102_200025704644 [0,0,1,0,0,1|0,0,2]=4 2932 B11R1.91 [13CH3]C(=O)C=Cc1ccccc1 1458a_100000210462_200025704644 [0,0,1,0,0,1|0,0,1]=3 2933 B11R1.91 [13CH3]C(=O)C=Cc1ccccn1 1458a_100000740811_200025704644 [0,0,1,0,0,1|1,0,1]=4 2934 B11R1.91 [13CH3]C(=O)C=Cc1cccnc1 1458a_100000735890_200025704644 [0,0,1,0,0,1|1,0,1]=4 2935 B11R1.91 [13CH3]C(=O)C=Cc1ccncc1 1458a_100000682801_200025704644 [0,0,1,0,0,1|1,0,1]=4 2936 B11R1.91 [13CH3]C(=O)CCc1ccccc1 1458a_100000185753_200025704644 [0,0,1,0,0,1|0,0,2]=4 2937 B11R1.91 [13CH3]C(=O)COc1ccccc1 1458a_100000186222_200025704644 [0,0,1,0,0,1|1,0,0]=3 2938 B11R1.91 [13CH3]C(=O)COc1ccccn1 1458a_100102699861_200025704644 [0,0,1,0,0,1|2,0,0]=4 2939 B11R1.91 [13CH3]C(=O)COc1cccnc1 1458a_100015207166_200025704644 [0,0,1,0,0,1|2,0,0]=4 2940 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,0,1,0,0,1|0,0,2]=4 2941 B11R1.9 C=Cc1cc(cc(c1)C=O)C 271570a_100011290941_100000686105 [0,0,1,0,0,1|2,0,0]=4 2942 B11R1.9 C=Cc1cc(nc(c1)C=O)C 271570a_100011290941_100009814795 [0,0,1,0,0,1|2,0,0]=4 2943 B11R1.37 C=Cc1cc(ccc1C=O)C 271570a_100011290941_100000692596 [0,0,1,0,0,1|2,0,0]=4 2944 B11R1.37 C=Cc1ccc(cc1C=O)C 271570a_100011290941_100011551863 [0,0,1,0,0,1|2,0,0]=4 2945 B11R1.37 C=Cc1ccc(nc1C=O)C 271570a_100011290941_100010173661 [0,0,1,0,0,1|2,0,0]=4 2946 B11R1.37 C=Cc1nc(ccc1C=O)C 271570a_100011290941_100000085379 [0,0,1,0,0,1|2,0,0]=4 2947 B11R1.37 C=Cc1ncc(cc1C=O)C 271570a_100011290941_100000050350 [0,0,1,0,0,1|2,0,0]=4 2948 B13R2.163 CN1CCOc2ccccc2C1 2230a_100000744108_200000210301 [0,0,0,0,0,2|1,0,1]=4 2949 B13R2.163 CN1CCOc2ccccc2C1 269982a_100000744108_200000210301 [0,0,0,0,0,2|1,0,1]=4 2950 B13R2.163 CN1CCOc2ccccc2C1 34a_100000744108_200000210301 [0,0,0,0,0,2|1,0,1]=4 2951 B13R2.163 [13CH3]N1CCOc2ccccc2C1 2230a_100000744108_200025704644 [0,0,0,0,0,2|1,0,1]=4 2952 B13R2.163 [13CH3]N1CCOc2ccccc2C1 269982a_100000744108_200025704644 [0,0,0,0,0,2|1,0,1]=4 2953 B13R2.163 [13CH3]N1CCOc2ccccc2C1 34a_100000744108_200025704644 [0,0,0,0,0,2|1,0,1]=4