0 B11R2.10 CN1Cc2ccccc2C1 2230a_100000752595_200000210301 [0,0,0,0,0,0|4,0,0]=4 1 B11R2.10 CN1Cc2ccccc2C1 269982a_100000752595_200000210301 [0,0,0,0,0,0|4,0,0]=4 2 B11R2.10 CN1Cc2ccccc2C1 34a_100000752595_200000210301 [0,0,0,0,0,0|4,0,0]=4 3 B11R2.10 Oc1cc2ccccc2[nH]1 271570a_203496583355_100010232065 [0,0,0,0,0,0|1,1,0]=2 4 B11R2.10 Oc1cc2ccccc2o1 271570a_203496583355_100010159458 [0,0,0,0,0,0|1,2,0]=3 5 B11R2.10 Oc1cc2ccccc2s1 271570a_203496583355_100009816949 [0,0,0,0,0,0|1,1,0]=2 6 B11R2.10 Oc1cc2cccnc2[nH]1 271570a_203496583355_100010079843 [0,0,0,0,0,0|2,1,0]=3 7 B11R2.10 Oc1cn2ccccc2n1 271570a_203496583355_100009819586 [0,0,0,0,0,0|2,1,1]=4 8 B11R2.10 Oc1nc2ccccc2[nH]1 271570a_203496583355_100009814255 [0,0,0,0,0,0|1,1,0]=2 9 B11R2.10 Oc1nc2ccccc2s1 271570a_203496583355_100000751744 [0,0,0,0,0,0|0,1,1]=2 10 B11R2.10 Oc1nc2cccnc2s1 271570a_203496583355_100010188088 [0,0,0,0,0,0|1,1,1]=3 11 B11R2.10 [13CH3]N1Cc2ccccc2C1 2230a_100000752595_200025704644 [0,0,0,0,0,0|4,0,0]=4 12 B11R2.10 [13CH3]N1Cc2ccccc2C1 269982a_100000752595_200025704644 [0,0,0,0,0,0|4,0,0]=4 13 B11R2.10 [13CH3]N1Cc2ccccc2C1 34a_100000752595_200025704644 [0,0,0,0,0,0|4,0,0]=4 14 B12R2.18 Cc1c(sc2c1cccc2)O 271570a_203496583355_200010198769 [0,1,0,0,0,0|1,1,0]=3 15 B12R2.18 Cc1oc2ccccc2c1O 271570a_203496583355_200010236113 [0,1,0,0,0,0|2,1,0]=4 16 B12R2.18 Cc1sc2ccccc2c1O 271570a_203496583355_100010002616 [0,1,0,0,0,0|2,0,0]=3 17 B12R2.18 Cn1c(nc2c1cccc2)O 271570a_203496583355_200000239431 [0,1,0,0,0,0|1,1,0]=3 18 B12R2.32 C=Cc1cc2ccccc2[nH]1 271570a_100011290941_100010232065 [0,1,0,0,0,0|2,0,0]=3 19 B12R2.32 C=Cc1cc2ccccc2o1 271570a_100011290941_100010159458 [0,1,0,0,0,0|2,1,0]=4 20 B12R2.32 C=Cc1cc2ccccc2s1 271570a_100011290941_100009816949 [0,1,0,0,0,0|2,0,0]=3 21 B12R2.32 C=Cc1cc2cccnc2[nH]1 271570a_100011290941_100010079843 [0,1,0,0,0,0|3,0,0]=4 22 B12R2.32 C=Cc1nc2ccccc2[nH]1 271570a_100011290941_100009814255 [0,1,0,0,0,0|2,0,0]=3 23 B12R2.32 C=Cc1nc2ccccc2s1 271570a_100011290941_100000751744 [0,1,0,0,0,0|1,0,1]=3 24 B12R2.32 C=Cc1nc2cccnc2s1 271570a_100011290941_100010188088 [0,1,0,0,0,0|2,0,1]=4 25 B12R2.32 CNc1nc2ccccc2[nH]1 27a_100102657272_100009814255 [0,1,0,0,0,0|2,0,0]=3 26 B12R2.32 CNc1nc2ccccc2s1 27a_100102657272_100000751744 [0,1,0,0,0,0|1,0,1]=3 27 B12R2.32 CNc1nc2cccnc2s1 27a_100102657272_100010188088 [0,1,0,0,0,0|2,0,1]=4 28 B12R2.32 CSc1cc2ccccc2[nH]1 62a_200000210301_100010232065 [0,1,0,0,0,0|1,0,1]=3 29 B12R2.32 CSc1cc2ccccc2o1 62a_200000210301_100010159458 [0,1,0,0,0,0|1,1,1]=4 30 B12R2.32 CSc1cc2ccccc2s1 62a_200000210301_100009816949 [0,1,0,0,0,0|1,0,1]=3 31 B12R2.32 CSc1cc2cccnc2[nH]1 62a_200000210301_100010079843 [0,1,0,0,0,0|2,0,1]=4 32 B12R2.32 CSc1nc2ccccc2[nH]1 62a_200000210301_100009814255 [0,1,0,0,0,0|1,0,1]=3 33 B12R2.32 CSc1nc2ccccc2s1 62a_200000210301_100000751744 [0,1,0,0,0,0|0,0,2]=3 34 B12R2.32 CSc1nc2cccnc2s1 62a_100010188088_200000210301 [0,1,0,0,0,0|1,0,2]=4 35 B12R2.32 CSc1nc2cccnc2s1 62a_200000210301_100010188088 [0,1,0,0,0,0|1,0,2]=4 36 B12R2.32 [13CH3]Sc1cc2ccccc2[nH]1 62a_200025704644_100010232065 [0,1,0,0,0,0|1,0,1]=3 37 B12R2.32 [13CH3]Sc1cc2ccccc2o1 62a_200025704644_100010159458 [0,1,0,0,0,0|1,1,1]=4 38 B12R2.32 [13CH3]Sc1cc2ccccc2s1 62a_200025704644_100009816949 [0,1,0,0,0,0|1,0,1]=3 39 B12R2.32 [13CH3]Sc1cc2cccnc2[nH]1 62a_200025704644_100010079843 [0,1,0,0,0,0|2,0,1]=4 40 B12R2.32 [13CH3]Sc1nc2ccccc2[nH]1 62a_200025704644_100009814255 [0,1,0,0,0,0|1,0,1]=3 41 B12R2.32 [13CH3]Sc1nc2ccccc2s1 62a_200025704644_100000751744 [0,1,0,0,0,0|0,0,2]=3 42 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_100010188088_200025704644 [0,1,0,0,0,0|1,0,2]=4 43 B12R2.32 [13CH3]Sc1nc2cccnc2s1 62a_200025704644_100010188088 [0,1,0,0,0,0|1,0,2]=4 44 B12R2.202 CC1=Cc2cccc(c2C1)O 271570a_203496583355_100010271545 [0,1,0,0,0,0|3,0,0]=4 45 B12R2.202 Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010143266 [0,1,0,0,0,0|2,0,0]=3 46 B12R2.202 Cc1cc2c(ccnc2[nH]1)O 271570a_203496583355_100010202352 [0,1,0,0,0,0|3,0,0]=4 47 B12R2.202 Cc1cccc2c1nc(s2)O 271570a_203496583355_100010008827 [0,1,0,0,0,0|0,1,1]=3 48 B12R2.202 Cc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012360556 [0,1,0,0,0,0|2,0,0]=3 49 B12R2.202 Cc1nc2c(cccc2o1)O 271570a_203496583355_100010883239 [0,1,0,0,0,0|1,1,1]=4 50 B12R2.202 Cc1nc2c(cccc2s1)O 271570a_203496583355_100010236672 [0,1,0,0,0,0|1,0,1]=3 51 B12R2.202 Cc1nc2cccc(c2o1)O 271570a_203496583355_100010168998 [0,1,0,0,0,0|1,1,1]=4 52 B12R2.202 Cc1nc2cccc(c2s1)O 271570a_203496583355_100010236699 [0,1,0,0,0,0|1,0,1]=3 53 B12R2.202 Nc1cc2cccc(c2s1)O 271570a_203496583355_100010090802 [0,1,0,0,0,0|2,0,0]=3 54 B12R2.202 Nc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012356985 [0,1,0,0,0,0|2,0,0]=3 55 B12R2.202 Nc1nc2c(cccc2s1)O 271570a_203496583355_100000724365 [0,1,0,0,0,0|1,0,1]=3 56 B12R2.202 Nc1nc2cccc(c2o1)O 271570a_203496583355_100012347120 [0,1,0,0,0,0|1,1,1]=4 57 B12R2.202 Nc1nc2cccc(c2s1)O 271570a_203496583355_100010235960 [0,1,0,0,0,0|1,0,1]=3 58 B12R2.202 O=C1Cc2c(cccc2N1)O 271570a_203496583355_100009816812 [0,1,0,0,0,0|1,1,0]=3 59 B12R2.202 O=C1Cc2c(ccnc2N1)O 271570a_203496583355_100000104061 [0,1,0,0,0,0|2,1,0]=4 60 B12R2.202 O=C1Cc2cccc(c2C1)O 271570a_203496583355_100010205903 [0,1,0,0,0,0|2,1,0]=4 61 B12R2.202 O=C1Cc2cccc(c2N1)O 271570a_203496583355_100000767046 [0,1,0,0,0,0|1,1,0]=3 62 B12R2.202 O=c1[nH]c2cccc(c2o1)O 271570a_203496583355_100012360093 [0,1,0,0,0,0|0,2,0]=3 63 B12R2.202 O=c1[nH]c2nccc(c2[nH]1)O 271570a_203496583355_100009840862 [0,1,0,0,0,0|2,1,0]=4 64 B12R2.202 Oc1cc2c(ccnc2[nH]1)Cl 271570a_203496583355_100010234028 [0,1,0,0,0,0|2,1,0]=4 65 B12R2.202 Oc1cc2c(nccc2s1)O 271570a_203496583355_100010116216 [0,1,0,0,0,0|2,1,0]=4 66 B12R2.202 Oc1cc2cccc(c2[nH]1)Br 271570a_203496583355_100135389745 [0,1,0,0,0,0|1,1,0]=3 67 B12R2.202 Oc1cc2nccc(c2s1)Cl 271570a_203496583355_100010192579 [0,1,0,0,0,0|2,1,0]=4 68 B12R2.202 Oc1nc2c(cccc2[nH]1)O 271570a_203496583355_100012347640 [0,1,0,0,0,0|1,1,0]=3 69 B12R2.202 Oc1nc2c(cccc2s1)F 271570a_203496583355_100010008856 [0,1,0,0,0,0|0,1,1]=3 70 B12R2.202 Oc1nc2c(cncc2[nH]1)O 271570a_203496583355_100012340553 [0,1,0,0,0,0|2,1,0]=4 71 B12R2.606 Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100011214893 [0,1,0,0,0,0|2,0,0]=3 72 B12R2.606 Cc1cc2cc(ccc2s1)O 271570a_203496583355_100000695401 [0,1,0,0,0,0|2,0,0]=3 73 B12R2.606 Cc1cc2cc(cnc2[nH]1)O 271570a_203496583355_100010202332 [0,1,0,0,0,0|3,0,0]=4 74 B12R2.606 Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010196937 [0,1,0,0,0,0|2,0,0]=3 75 B12R2.606 Cc1cc2ncc(cc2[nH]1)O 271570a_203496583355_100010168555 [0,1,0,0,0,0|3,0,0]=4 76 B12R2.606 Cc1ccc2nc(sc2c1)O 271570a_203496583355_100010186437 [0,1,0,0,0,0|0,1,1]=3 77 B12R2.606 Cc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100011264012 [0,1,0,0,0,0|2,0,0]=3 78 B12R2.606 Cc1nc2cc(ccc2o1)O 271570a_203496583355_100009816932 [0,1,0,0,0,0|1,1,1]=4 79 B12R2.606 Cc1nc2cc(ccc2s1)O 271570a_203496583355_100009813953 [0,1,0,0,0,0|1,0,1]=3 80 B12R2.606 Cc1nc2cc(cnc2s1)O 271570a_203496583355_100010178691 [0,1,0,0,0,0|2,0,1]=4 81 B12R2.606 Cc1nc2ccc(cc2o1)O 271570a_203496583355_100010171164 [0,1,0,0,0,0|1,1,1]=4 82 B12R2.606 Cc1nc2ccc(cc2s1)O 271570a_203496583355_100009813144 [0,1,0,0,0,0|1,0,1]=3 83 B12R2.606 Cc1nc2ccc(nc2[nH]1)O 271570a_203496583355_100000079090 [0,1,0,0,0,0|3,0,0]=4 84 B12R2.606 Cc1nc2ncc(cc2[nH]1)O 271570a_203496583355_100000758206 [0,1,0,0,0,0|3,0,0]=4 85 B12R2.606 Nc1ccc2nc(sc2c1)O 271570a_203496583355_100010253933 [0,1,0,0,0,0|0,1,1]=3 86 B12R2.606 Nc1ccc2sc(nc2c1)O 271570a_203496583355_100010329861 [0,1,0,0,0,0|0,1,1]=3 87 B12R2.606 Nc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000764686 [0,1,0,0,0,0|2,0,0]=3 88 B12R2.606 Nc1nc2cc(ccc2o1)O 271570a_203496583355_100000737949 [0,1,0,0,0,0|1,1,1]=4 89 B12R2.606 Nc1nc2cc(ccc2s1)O 271570a_203496583355_100011934045 [0,1,0,0,0,0|1,0,1]=3 90 B12R2.606 Nc1nc2cc(cnc2s1)O 271570a_203496583355_100010244814 [0,1,0,0,0,0|2,0,1]=4 91 B12R2.606 Nc1nc2cc(ncc2s1)O 271570a_203496583355_100009884557 [0,1,0,0,0,0|2,0,1]=4 92 B12R2.606 Nc1nc2ccc(cc2o1)O 271570a_203496583355_100010000678 [0,1,0,0,0,0|1,1,1]=4 93 B12R2.606 Nc1nc2ccc(cc2s1)O 271570a_203496583355_100102524914 [0,1,0,0,0,0|1,0,1]=3 94 B12R2.606 Nc1nc2ccc(nc2s1)O 271570a_203496583355_100000075896 [0,1,0,0,0,0|2,0,1]=4 95 B12R2.606 O=C1Cc2cc(ccc2N1)O 271570a_203496583355_100000754858 [0,1,0,0,0,0|1,1,0]=3 96 B12R2.606 O=C1Cc2cc(cnc2N1)O 271570a_203496583355_100010177629 [0,1,0,0,0,0|2,1,0]=4 97 B12R2.606 O=C1Cc2cc(ncc2N1)O 271570a_203496583355_100000104063 [0,1,0,0,0,0|2,1,0]=4 98 B12R2.606 O=C1Cc2ccc(cc2C1)O 271570a_203496583355_100010185598 [0,1,0,0,0,0|2,1,0]=4 99 B12R2.606 O=C1Cc2ccc(cc2N1)O 271570a_203496583355_100000760487 [0,1,0,0,0,0|1,1,0]=3 100 B12R2.606 O=C1Cc2ccc(nc2N1)O 271570a_203496583355_100000104062 [0,1,0,0,0,0|2,1,0]=4 101 B12R2.606 O=C1Cc2cnc(cc2N1)O 271570a_203496583355_100000089690 [0,1,0,0,0,0|2,1,0]=4 102 B12R2.606 O=C1Cc2nc(ccc2N1)O 271570a_203496583355_100000087150 [0,1,0,0,0,0|2,1,0]=4 103 B12R2.606 O=C1Cc2ncc(cc2N1)O 271570a_203496583355_100010168558 [0,1,0,0,0,0|2,1,0]=4 104 B12R2.606 O=c1[nH]c2cc(ccc2o1)O 271570a_203496583355_100000764829 [0,1,0,0,0,0|0,2,0]=3 105 B12R2.606 O=c1[nH]c2cc(ccc2s1)O 271570a_203496583355_100000239354 [0,1,0,0,0,0|0,1,0]=2 106 B12R2.606 O=c1[nH]c2ccc(cc2[nH]1)O 271570a_203496583355_100011221360 [0,1,0,0,0,0|1,1,0]=3 107 B12R2.606 O=c1[nH]c2ccc(cc2o1)O 271570a_203496583355_100000697996 [0,1,0,0,0,0|0,2,0]=3 108 B12R2.606 O=c1[nH]c2ccc(cc2s1)O 271570a_203496583355_100009813980 [0,1,0,0,0,0|0,1,0]=2 109 B12R2.606 O=c1[nH]c2ccc(nc2[nH]1)O 271570a_203496583355_100000084209 [0,1,0,0,0,0|2,1,0]=4 110 B12R2.606 O=c1[nH]c2ncc(cc2o1)O 271570a_203496583355_100000721845 [0,1,0,0,0,0|1,2,0]=4 111 B12R2.606 Oc1cc2[nH]c(nc2cn1)O 271570a_203496583355_100010516660 [0,1,0,0,0,0|2,1,0]=4 112 B12R2.606 Oc1cc2cc(ccc2[nH]1)Br 271570a_203496583355_100011012855 [0,1,0,0,0,0|1,1,0]=3 113 B12R2.606 Oc1cc2cc(ccc2s1)Br 271570a_203496583355_200010198765 [0,1,0,0,0,0|1,1,0]=3 114 B12R2.606 Oc1ccc2nc(sc2c1)Cl 271570a_203496583355_100010163703 [0,1,0,0,0,0|1,0,1]=3 115 B12R2.606 Oc1ccc2nc(sc2c1)O 271570a_203496583355_100010063415 [0,1,0,0,0,0|0,1,1]=3 116 B12R2.606 Oc1cnc2[nH]c(nc2c1)O 271570a_203496583355_100000755142 [0,1,0,0,0,0|2,1,0]=4 117 B12R2.606 Oc1nc2cc(ccc2s1)F 271570a_203496583355_200010206605 [0,1,0,0,0,0|0,1,1]=3 118 B12R2.606 Oc1nc2ccc(cc2s1)F 271570a_203496583355_100000751617 [0,1,0,0,0,0|0,1,1]=3 119 B12R2.606 Oc1nc2ccc(nc2s1)F 271570a_203496583355_200010738066 [0,1,0,0,0,0|1,1,1]=4 120 B10R1.4 C=C=Cc1ccccc1N 271570a_100015277604_100000210017 [0,0,1,0,0,0|2,0,1]=4 121 B10R1.4 C=CCc1ccccc1O 271570a_203496583355_100009828059 [0,0,1,0,0,0|2,1,0]=4 122 B10R1.4 CC=Cc1ccccc1Br 271570a_100016259895_100000695589 [0,0,1,0,0,0|3,0,0]=4 123 B10R1.4 CC=Cc1ccccc1C 271570a_100016259895_100000210755 [0,0,1,0,0,0|3,0,0]=4 124 B10R1.4 CC=Cc1ccccc1Cl 271570a_100016259895_100000764095 [0,0,1,0,0,0|3,0,0]=4 125 B10R1.4 CC=Cc1ccccc1F 271570a_100016259895_100011215700 [0,0,1,0,0,0|3,0,0]=4 126 B10R1.4 CC=Cc1ccccc1N 271570a_100016259895_100000210017 [0,0,1,0,0,0|2,0,0]=3 127 B10R1.4 CC=Cc1ccccc1O 271570a_100016259895_100000739446 [0,0,1,0,0,0|2,1,0]=4 128 B10R1.4 CC=Cc1cccnc1N 271570a_100016259895_100000045569 [0,0,1,0,0,0|3,0,0]=4 129 B10R1.4 CC=Cc1ccncc1N 271570a_100016259895_100009815883 [0,0,1,0,0,0|3,0,0]=4 130 B10R1.4 CC=Cc1cnccc1N 271570a_100016259895_100000047001 [0,0,1,0,0,0|3,0,0]=4 131 B10R1.4 CC=Cc1ncccc1N 271570a_100016259895_100000688686 [0,0,1,0,0,0|3,0,0]=4 132 B10R1.4 CCNc1ccccc1Br 34a_100000210017_100000210202 [0,0,1,0,0,0|2,0,1]=4 133 B10R1.4 CCNc1ccccc1C 34a_100015192222_100000210202 [0,0,1,0,0,0|2,0,1]=4 134 B10R1.4 CCNc1ccccc1Cl 34a_100000185783_100000210202 [0,0,1,0,0,0|2,0,1]=4 135 B10R1.4 CCNc1ccccc1F 34a_100000210422_100000210202 [0,0,1,0,0,0|2,0,1]=4 136 B10R1.4 CCNc1ccccc1I 34a_100000210053_100000210202 [0,0,1,0,0,0|2,0,1]=4 137 B10R1.4 CCNc1ccccc1O 271570a_203496583355_114873767003 [0,0,1,0,0,0|1,1,1]=4 138 B10R1.4 CCNc1ccccc1O 34a_100000185747_100000210202 [0,0,1,0,0,0|1,1,1]=4 139 B10R1.4 CCOc1ccccc1N 34a_100000185747_100000210202 [0,0,1,0,0,0|1,1,1]=4 140 B10R1.4 CCOc1ccccc1N 7a_100000185747_100000210202 [0,0,1,0,0,0|1,1,1]=4 141 B10R1.4 CCSc1ccccc1Br 62a_100000210202_100000695589 [0,0,1,0,0,0|2,0,1]=4 142 B10R1.4 CCSc1ccccc1Br 62a_100000695589_100000210202 [0,0,1,0,0,0|2,0,1]=4 143 B10R1.4 CCSc1ccccc1C 62a_100000210202_100000210755 [0,0,1,0,0,0|2,0,1]=4 144 B10R1.4 CCSc1ccccc1C 62a_100000210755_100000210202 [0,0,1,0,0,0|2,0,1]=4 145 B10R1.4 CCSc1ccccc1Cl 62a_100000210202_100000764095 [0,0,1,0,0,0|2,0,1]=4 146 B10R1.4 CCSc1ccccc1Cl 62a_100000764095_100000210202 [0,0,1,0,0,0|2,0,1]=4 147 B10R1.4 CCSc1ccccc1F 62a_100000210202_100011215700 [0,0,1,0,0,0|2,0,1]=4 148 B10R1.4 CCSc1ccccc1F 62a_100011215700_100000210202 [0,0,1,0,0,0|2,0,1]=4 149 B10R1.4 CCSc1ccccc1N 62a_100000210017_100000210202 [0,0,1,0,0,0|1,0,1]=3 150 B10R1.4 CCSc1ccccc1N 62a_100000210202_100000210017 [0,0,1,0,0,0|1,0,1]=3 151 B10R1.4 CCSc1ccccc1O 271570a_203496583355_100000230856 [0,0,1,0,0,0|2,0,1]=4 152 B10R1.4 CCSc1ccccc1O 62a_100000210202_100000739446 [0,0,1,0,0,0|2,0,1]=4 153 B10R1.4 CCSc1ccccc1O 62a_100000739446_100000210202 [0,0,1,0,0,0|2,0,1]=4 154 B10R1.4 CCSc1cccnc1N 62a_100000045569_100000210202 [0,0,1,0,0,0|2,0,1]=4 155 B10R1.4 CCSc1cccnc1N 62a_100000210202_100000045569 [0,0,1,0,0,0|2,0,1]=4 156 B10R1.4 CCSc1ccncc1N 62a_100000210202_100000756074 [0,0,1,0,0,0|2,0,1]=4 157 B10R1.4 CCSc1ccncc1N 62a_100000756074_100000210202 [0,0,1,0,0,0|2,0,1]=4 158 B10R1.4 CCSc1cnccc1N 62a_100000047001_100000210202 [0,0,1,0,0,0|2,0,1]=4 159 B10R1.4 CCSc1cnccc1N 62a_100000210202_100000047001 [0,0,1,0,0,0|2,0,1]=4 160 B10R1.4 CCSc1ncccc1N 62a_100000210202_100000688686 [0,0,1,0,0,0|2,0,1]=4 161 B10R1.4 CCSc1ncccc1N 62a_100000688686_100000210202 [0,0,1,0,0,0|2,0,1]=4 162 B10R1.4 COCc1ccccc1N 34a_100000212039_200000210301 [0,0,1,0,0,0|3,0,0]=4 163 B10R1.4 Cc1ccccc1NCF 34a_100015192222_100015361967 [0,0,1,0,0,0|2,0,1]=4 164 B10R1.4 Cc1ccccc1SCF 62a_100000210755_100015361967 [0,0,1,0,0,0|2,0,1]=4 165 B10R1.4 Cc1ccccc1SCF 62a_100015361967_100000210755 [0,0,1,0,0,0|2,0,1]=4 166 B10R1.4 FCNc1ccccc1Br 34a_100000210017_100015361967 [0,0,1,0,0,0|2,0,1]=4 167 B10R1.4 FCNc1ccccc1Cl 34a_100000185783_100015361967 [0,0,1,0,0,0|2,0,1]=4 168 B10R1.4 FCNc1ccccc1F 34a_100000210422_100015361967 [0,0,1,0,0,0|2,0,1]=4 169 B10R1.4 FCNc1ccccc1I 34a_100000210053_100015361967 [0,0,1,0,0,0|2,0,1]=4 170 B10R1.4 FCSc1ccccc1Br 62a_100000695589_100015361967 [0,0,1,0,0,0|2,0,1]=4 171 B10R1.4 FCSc1ccccc1Br 62a_100015361967_100000695589 [0,0,1,0,0,0|2,0,1]=4 172 B10R1.4 FCSc1ccccc1Cl 62a_100000764095_100015361967 [0,0,1,0,0,0|2,0,1]=4 173 B10R1.4 FCSc1ccccc1Cl 62a_100015361967_100000764095 [0,0,1,0,0,0|2,0,1]=4 174 B10R1.4 FCSc1ccccc1F 62a_100011215700_100015361967 [0,0,1,0,0,0|2,0,1]=4 175 B10R1.4 FCSc1ccccc1F 62a_100015361967_100011215700 [0,0,1,0,0,0|2,0,1]=4 176 B10R1.4 Nc1ccccc1OCF 34a_100000185747_100015361967 [0,0,1,0,0,0|1,1,1]=4 177 B10R1.4 Nc1ccccc1OCF 7a_100000185747_100015361967 [0,0,1,0,0,0|1,1,1]=4 178 B10R1.4 Nc1ccccc1SCF 62a_100000210017_100015361967 [0,0,1,0,0,0|1,0,1]=3 179 B10R1.4 Nc1ccccc1SCF 62a_100015361967_100000210017 [0,0,1,0,0,0|1,0,1]=3 180 B10R1.4 Nc1cccnc1SCF 62a_100000688686_100015361967 [0,0,1,0,0,0|2,0,1]=4 181 B10R1.4 Nc1cccnc1SCF 62a_100015361967_100000688686 [0,0,1,0,0,0|2,0,1]=4 182 B10R1.4 Nc1ccncc1SCF 62a_100000047001_100015361967 [0,0,1,0,0,0|2,0,1]=4 183 B10R1.4 Nc1ccncc1SCF 62a_100015361967_100000047001 [0,0,1,0,0,0|2,0,1]=4 184 B10R1.4 Nc1cnccc1SCF 62a_100000756074_100015361967 [0,0,1,0,0,0|2,0,1]=4 185 B10R1.4 Nc1cnccc1SCF 62a_100015361967_100000756074 [0,0,1,0,0,0|2,0,1]=4 186 B10R1.4 Nc1ncccc1SCF 62a_100000045569_100015361967 [0,0,1,0,0,0|2,0,1]=4 187 B10R1.4 Nc1ncccc1SCF 62a_100015361967_100000045569 [0,0,1,0,0,0|2,0,1]=4 188 B10R1.4 Oc1ccccc1NCF 34a_100000185747_100015361967 [0,0,1,0,0,0|1,1,1]=4 189 B10R1.4 Oc1ccccc1SCF 62a_100000739446_100015361967 [0,0,1,0,0,0|2,0,1]=4 190 B10R1.4 Oc1ccccc1SCF 62a_100015361967_100000739446 [0,0,1,0,0,0|2,0,1]=4 191 B10R1.4 [13CH3]OCc1ccccc1N 34a_100000212039_200025704644 [0,0,1,0,0,0|3,0,0]=4 192 B10R1.18 CC(=Cc1ccccc1)C 271570a_100102525489_100000210277 [0,0,1,0,0,0|3,0,0]=4 193 B10R1.18 CC(=O)Cc1ccccc1 1458a_100000070787_100015291786 [0,0,1,0,0,0|2,1,0]=4 194 B10R1.18 CC(=O)Nc1ccccc1 11a_100000106764_100015343762 [0,0,1,0,0,0|1,1,0]=3 195 B10R1.18 CC(=O)Nc1ccccc1 1626a_100000106764_100015343762 [0,0,1,0,0,0|1,1,0]=3 196 B10R1.18 CC(=O)Nc1ccccc1 22a_100000106764_100000070787 [0,0,1,0,0,0|1,1,0]=3 197 B10R1.18 CC(=O)Nc1ccccc1 527a_100000106764_100103153847 [0,0,1,0,0,0|1,1,0]=3 198 B10R1.18 CC(C)Nc1ccccc1 34a_100000106764_100000210206 [0,0,1,0,0,0|2,0,1]=4 199 B10R1.18 CC(C)Sc1ccccc1 62a_100000210206_100000041952 [0,0,1,0,0,0|2,0,1]=4 200 B10R1.18 CC(C)Sc1ccccc1 62a_100000719477_100000210206 [0,0,1,0,0,0|2,0,1]=4 201 B10R1.32 C=Cc1cc(sc1C=O)C 271570a_100011290941_100011361552 [0,0,1,0,0,0|3,0,0]=4 202 B10R2.2 Oc1cc2sccc2s1 271570a_203496583355_200010191111 [0,0,0,0,1,0|2,1,0]=4 203 B12R2.24 Oc1cc2ccccc2cn1 271570a_203496583355_100000047361 [0,0,0,0,0,1|1,1,1]=4 204 B12R2.24 Oc1ccc2ccccc2c1 271570a_203496583355_100000233703 [0,0,0,0,0,1|2,1,0]=4 205 B12R2.24 Oc1ccc2ccccc2n1 271570a_203496583355_100011291633 [0,0,0,0,0,1|1,1,1]=4 206 B12R2.24 Oc1cnc2ccccc2c1 271570a_203496583355_100000737414 [0,0,0,0,0,1|1,1,1]=4 207 B12R2.24 Oc1cnc2ccccc2n1 271570a_203496583355_100000756483 [0,0,0,0,0,1|1,1,1]=4 208 B12R2.24 Oc1ncc2ccccc2n1 271570a_203496583355_100000097389 [0,0,0,0,0,1|1,1,1]=4 209 B9R1.8 CC=Cc1ccccc1 271570a_100016259895_100000210277 [1,0,1,0,0,0|2,0,0]=4 210 B9R1.8 CCNc1ccccc1 34a_100000106764_100000210202 [1,0,1,0,0,0|1,0,1]=4 211 B9R1.8 CCSc1ccccc1 62a_100000210202_100000041952 [1,0,1,0,0,0|1,0,1]=4 212 B9R1.8 CCSc1ccccc1 62a_100000719477_100000210202 [1,0,1,0,0,0|1,0,1]=4 213 B9R1.8 FCNc1ccccc1 34a_100000106764_100015361967 [1,0,1,0,0,0|1,0,1]=4 214 B9R1.8 FCSc1ccccc1 62a_100000719477_100015361967 [1,0,1,0,0,0|1,0,1]=4 215 B9R1.8 FCSc1ccccc1 62a_100015361967_100000041952 [1,0,1,0,0,0|1,0,1]=4 216 B9R1.15 C=Cc1ccccc1Br 271570a_100011290941_100000695589 [1,0,1,0,0,0|2,0,0]=4 217 B9R1.15 C=Cc1ccccc1C 271570a_100011290941_100000210755 [1,0,1,0,0,0|2,0,0]=4 218 B9R1.15 C=Cc1ccccc1Cl 271570a_100011290941_100000764095 [1,0,1,0,0,0|2,0,0]=4 219 B9R1.15 C=Cc1ccccc1F 271570a_100011290941_100011215700 [1,0,1,0,0,0|2,0,0]=4 220 B9R1.15 C=Cc1ccccc1N 271570a_100011290941_100000210017 [1,0,1,0,0,0|1,0,0]=3 221 B9R1.15 C=Cc1ccccc1O 271570a_100011290941_100000739446 [1,0,1,0,0,0|1,1,0]=4 222 B9R1.15 C=Cc1cccnc1N 271570a_100011290941_100000045569 [1,0,1,0,0,0|2,0,0]=4 223 B9R1.15 C=Cc1ccncc1N 271570a_100011290941_100009815883 [1,0,1,0,0,0|2,0,0]=4 224 B9R1.15 C=Cc1cnccc1N 271570a_100011290941_100000047001 [1,0,1,0,0,0|2,0,0]=4 225 B9R1.15 C=Cc1ncccc1N 271570a_100011290941_100000688686 [1,0,1,0,0,0|2,0,0]=4 226 B9R1.15 CNc1ccccc1Br 34a_100000210017_200000210301 [1,0,1,0,0,0|1,0,1]=4 227 B9R1.15 CNc1ccccc1C 34a_100015192222_200000210301 [1,0,1,0,0,0|1,0,1]=4 228 B9R1.15 CNc1ccccc1Cl 34a_100000185783_200000210301 [1,0,1,0,0,0|1,0,1]=4 229 B9R1.15 CNc1ccccc1F 34a_100000210422_200000210301 [1,0,1,0,0,0|1,0,1]=4 230 B9R1.15 CNc1ccccc1I 34a_100000210053_200000210301 [1,0,1,0,0,0|1,0,1]=4 231 B9R1.15 CNc1ccccc1O 271570a_203496583355_100020606079 [1,0,1,0,0,0|0,1,1]=4 232 B9R1.15 CNc1ccccc1O 34a_100000185747_200000210301 [1,0,1,0,0,0|0,1,1]=4 233 B9R1.15 COc1ccccc1N 34a_100000185747_200000210301 [1,0,1,0,0,0|0,1,1]=4 234 B9R1.15 COc1ccccc1N 7a_100000185747_200000210301 [1,0,1,0,0,0|0,1,1]=4 235 B9R1.15 CSc1ccccc1Br 62a_100000695589_200000210301 [1,0,1,0,0,0|1,0,1]=4 236 B9R1.15 CSc1ccccc1Br 62a_200000210301_100000695589 [1,0,1,0,0,0|1,0,1]=4 237 B9R1.15 CSc1ccccc1C 62a_100000210755_200000210301 [1,0,1,0,0,0|1,0,1]=4 238 B9R1.15 CSc1ccccc1C 62a_200000210301_100000210755 [1,0,1,0,0,0|1,0,1]=4 239 B9R1.15 CSc1ccccc1Cl 62a_100000764095_200000210301 [1,0,1,0,0,0|1,0,1]=4 240 B9R1.15 CSc1ccccc1Cl 62a_200000210301_100000764095 [1,0,1,0,0,0|1,0,1]=4 241 B9R1.15 CSc1ccccc1F 62a_100011215700_200000210301 [1,0,1,0,0,0|1,0,1]=4 242 B9R1.15 CSc1ccccc1F 62a_200000210301_100011215700 [1,0,1,0,0,0|1,0,1]=4 243 B9R1.15 CSc1ccccc1N 62a_100000210017_200000210301 [1,0,1,0,0,0|0,0,1]=3 244 B9R1.15 CSc1ccccc1N 62a_200000210301_100000210017 [1,0,1,0,0,0|0,0,1]=3 245 B9R1.15 CSc1ccccc1O 271570a_203496583355_100011217816 [1,0,1,0,0,0|1,0,1]=4 246 B9R1.15 CSc1ccccc1O 62a_100000739446_200000210301 [1,0,1,0,0,0|1,0,1]=4 247 B9R1.15 CSc1ccccc1O 62a_200000210301_100000739446 [1,0,1,0,0,0|1,0,1]=4 248 B9R1.15 CSc1cccnc1N 62a_100000045569_200000210301 [1,0,1,0,0,0|1,0,1]=4 249 B9R1.15 CSc1cccnc1N 62a_200000210301_100000045569 [1,0,1,0,0,0|1,0,1]=4 250 B9R1.15 CSc1ccncc1N 62a_100000756074_200000210301 [1,0,1,0,0,0|1,0,1]=4 251 B9R1.15 CSc1ccncc1N 62a_200000210301_100000756074 [1,0,1,0,0,0|1,0,1]=4 252 B9R1.15 CSc1cnccc1N 62a_100000047001_200000210301 [1,0,1,0,0,0|1,0,1]=4 253 B9R1.15 CSc1cnccc1N 62a_200000210301_100000047001 [1,0,1,0,0,0|1,0,1]=4 254 B9R1.15 CSc1ncccc1N 62a_100000688686_200000210301 [1,0,1,0,0,0|1,0,1]=4 255 B9R1.15 CSc1ncccc1N 62a_200000210301_100000688686 [1,0,1,0,0,0|1,0,1]=4 256 B9R1.15 Cc1ccccc1N[13CH3] 34a_100015192222_200025704644 [1,0,1,0,0,0|1,0,1]=4 257 B9R1.15 Cc1ccccc1S[13CH3] 62a_100000210755_200025704644 [1,0,1,0,0,0|1,0,1]=4 258 B9R1.15 Cc1ccccc1S[13CH3] 62a_200025704644_100000210755 [1,0,1,0,0,0|1,0,1]=4 259 B9R1.15 NNc1ccccc1O 271570a_203496583355_100000241748 [1,0,1,0,0,0|1,1,0]=4 260 B9R1.15 O=Cc1ccccc1O 271570a_203496583355_100000211189 [1,0,1,0,0,0|0,2,0]=4 261 B9R1.15 [13CH3]Nc1ccccc1Br 34a_100000210017_200025704644 [1,0,1,0,0,0|1,0,1]=4 262 B9R1.15 [13CH3]Nc1ccccc1Cl 34a_100000185783_200025704644 [1,0,1,0,0,0|1,0,1]=4 263 B9R1.15 [13CH3]Nc1ccccc1F 34a_100000210422_200025704644 [1,0,1,0,0,0|1,0,1]=4 264 B9R1.15 [13CH3]Nc1ccccc1I 34a_100000210053_200025704644 [1,0,1,0,0,0|1,0,1]=4 265 B9R1.15 [13CH3]Nc1ccccc1O 34a_100000185747_200025704644 [1,0,1,0,0,0|0,1,1]=4 266 B9R1.15 [13CH3]Oc1ccccc1N 34a_100000185747_200025704644 [1,0,1,0,0,0|0,1,1]=4 267 B9R1.15 [13CH3]Oc1ccccc1N 7a_100000185747_200025704644 [1,0,1,0,0,0|0,1,1]=4 268 B9R1.15 [13CH3]Sc1ccccc1Br 62a_100000695589_200025704644 [1,0,1,0,0,0|1,0,1]=4 269 B9R1.15 [13CH3]Sc1ccccc1Br 62a_200025704644_100000695589 [1,0,1,0,0,0|1,0,1]=4 270 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_100000764095_200025704644 [1,0,1,0,0,0|1,0,1]=4 271 B9R1.15 [13CH3]Sc1ccccc1Cl 62a_200025704644_100000764095 [1,0,1,0,0,0|1,0,1]=4 272 B9R1.15 [13CH3]Sc1ccccc1F 62a_100011215700_200025704644 [1,0,1,0,0,0|1,0,1]=4 273 B9R1.15 [13CH3]Sc1ccccc1F 62a_200025704644_100011215700 [1,0,1,0,0,0|1,0,1]=4 274 B9R1.15 [13CH3]Sc1ccccc1N 62a_100000210017_200025704644 [1,0,1,0,0,0|0,0,1]=3 275 B9R1.15 [13CH3]Sc1ccccc1N 62a_200025704644_100000210017 [1,0,1,0,0,0|0,0,1]=3 276 B9R1.15 [13CH3]Sc1ccccc1O 62a_100000739446_200025704644 [1,0,1,0,0,0|1,0,1]=4 277 B9R1.15 [13CH3]Sc1ccccc1O 62a_200025704644_100000739446 [1,0,1,0,0,0|1,0,1]=4 278 B9R1.15 [13CH3]Sc1cccnc1N 62a_100000045569_200025704644 [1,0,1,0,0,0|1,0,1]=4 279 B9R1.15 [13CH3]Sc1cccnc1N 62a_200025704644_100000045569 [1,0,1,0,0,0|1,0,1]=4 280 B9R1.15 [13CH3]Sc1ccncc1N 62a_100000756074_200025704644 [1,0,1,0,0,0|1,0,1]=4 281 B9R1.15 [13CH3]Sc1ccncc1N 62a_200025704644_100000756074 [1,0,1,0,0,0|1,0,1]=4 282 B9R1.15 [13CH3]Sc1cnccc1N 62a_100000047001_200025704644 [1,0,1,0,0,0|1,0,1]=4 283 B9R1.15 [13CH3]Sc1cnccc1N 62a_200025704644_100000047001 [1,0,1,0,0,0|1,0,1]=4 284 B9R1.15 [13CH3]Sc1ncccc1N 62a_100000688686_200025704644 [1,0,1,0,0,0|1,0,1]=4 285 B9R1.15 [13CH3]Sc1ncccc1N 62a_200025704644_100000688686 [1,0,1,0,0,0|1,0,1]=4 286 B9R1.14 C=Cc1ccsc1C=O 271570a_100011290941_100000766043 [1,0,1,0,0,0|2,0,0]=4 287 B9R1.14 C=Cc1sccc1C=O 271570a_100011290941_100009816921 [1,0,1,0,0,0|2,0,0]=4 288 B11R1.13 CC=Cc1cccc(c1N)Br 271570a_100016259895_100010146558 [0,1,1,0,0,0|2,0,0]=4 289 B11R1.13 CC=Cc1cccc(c1N)C 271570a_100016259895_100011834072 [0,1,1,0,0,0|2,0,0]=4 290 B11R1.13 CC=Cc1cccc(c1N)Cl 271570a_100016259895_100010190421 [0,1,1,0,0,0|2,0,0]=4 291 B11R1.13 CC=Cc1cccc(c1N)F 271570a_100016259895_100000042321 [0,1,1,0,0,0|2,0,0]=4 292 B11R1.13 CC=Cc1cccc(c1N)N 271570a_100016259895_100015191791 [0,1,1,0,0,0|2,0,0]=4 293 B11R1.13 CC=Cc1cccc(c1N)O 271570a_100016259895_100011934926 [0,1,1,0,0,0|2,0,0]=4 294 B11R1.13 CCSc1cccc(c1N)Br 62a_100000210202_100010146558 [0,1,1,0,0,0|1,0,1]=4 295 B11R1.13 CCSc1cccc(c1N)Br 62a_100010146558_100000210202 [0,1,1,0,0,0|1,0,1]=4 296 B11R1.13 CCSc1cccc(c1N)C 62a_100000210202_100011834072 [0,1,1,0,0,0|1,0,1]=4 297 B11R1.13 CCSc1cccc(c1N)C 62a_100011834072_100000210202 [0,1,1,0,0,0|1,0,1]=4 298 B11R1.13 CCSc1cccc(c1N)Cl 62a_100000210202_100010190421 [0,1,1,0,0,0|1,0,1]=4 299 B11R1.13 CCSc1cccc(c1N)Cl 62a_100010190421_100000210202 [0,1,1,0,0,0|1,0,1]=4 300 B11R1.13 CCSc1cccc(c1N)F 62a_100000042321_100000210202 [0,1,1,0,0,0|1,0,1]=4 301 B11R1.13 CCSc1cccc(c1N)F 62a_100000210202_100000042321 [0,1,1,0,0,0|1,0,1]=4 302 B11R1.13 CCSc1cccc(c1N)N 62a_100015191791_100000210202 [0,1,1,0,0,0|1,0,1]=4 303 B11R1.13 CCSc1cccc(c1N)O 62a_100000210202_100011934926 [0,1,1,0,0,0|1,0,1]=4 304 B11R1.13 Cc1cccc(c1N)SCF 62a_100011834072_100015361967 [0,1,1,0,0,0|1,0,1]=4 305 B11R1.13 Cc1cccc(c1N)SCF 62a_100015361967_100011834072 [0,1,1,0,0,0|1,0,1]=4 306 B11R1.13 Nc1c(cccc1SCF)Br 62a_100010146558_100015361967 [0,1,1,0,0,0|1,0,1]=4 307 B11R1.13 Nc1c(cccc1SCF)Br 62a_100015361967_100010146558 [0,1,1,0,0,0|1,0,1]=4 308 B11R1.13 Nc1c(cccc1SCF)Cl 62a_100010190421_100015361967 [0,1,1,0,0,0|1,0,1]=4 309 B11R1.13 Nc1c(cccc1SCF)Cl 62a_100015361967_100010190421 [0,1,1,0,0,0|1,0,1]=4 310 B11R1.13 Nc1c(cccc1SCF)F 62a_100000042321_100015361967 [0,1,1,0,0,0|1,0,1]=4 311 B11R1.13 Nc1c(cccc1SCF)F 62a_100015361967_100000042321 [0,1,1,0,0,0|1,0,1]=4 312 B11R1.13 Nc1c(cccc1SCF)O 62a_100015361967_100011934926 [0,1,1,0,0,0|1,0,1]=4 313 B11R1.13 Nc1cccc(c1N)SCF 62a_100015191791_100015361967 [0,1,1,0,0,0|1,0,1]=4 314 B11R1.17 C#CCSc1ccccc1N 62a_100000038162_100000210017 [0,1,1,0,0,0|1,0,1]=4 315 B11R1.17 C=CCNc1ccccc1Br 34a_100000210017_100015514636 [0,1,1,0,0,0|2,0,0]=4 316 B11R1.17 C=CCNc1ccccc1C 34a_100015192222_100015514636 [0,1,1,0,0,0|2,0,0]=4 317 B11R1.17 C=CCNc1ccccc1Cl 34a_100000185783_100015514636 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.17 C=CCNc1ccccc1F 34a_100000210422_100015514636 [0,1,1,0,0,0|2,0,0]=4 319 B11R1.17 C=CCNc1ccccc1I 34a_100000210053_100015514636 [0,1,1,0,0,0|2,0,0]=4 320 B11R1.17 C=CCNc1ccccc1O 34a_100000185747_100015514636 [0,1,1,0,0,0|1,1,0]=4 321 B11R1.17 C=CCOc1ccccc1N 34a_100000185747_100015514636 [0,1,1,0,0,0|1,1,0]=4 322 B11R1.17 C=CCOc1ccccc1N 7a_100000185747_100015514636 [0,1,1,0,0,0|1,1,0]=4 323 B11R1.17 C=CCSc1ccccc1Br 62a_100000210623_100000695589 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.17 C=CCSc1ccccc1Br 62a_100000695589_100000210623 [0,1,1,0,0,0|2,0,0]=4 325 B11R1.17 C=CCSc1ccccc1C 62a_100000210623_100000210755 [0,1,1,0,0,0|2,0,0]=4 326 B11R1.17 C=CCSc1ccccc1C 62a_100000210755_100000210623 [0,1,1,0,0,0|2,0,0]=4 327 B11R1.17 C=CCSc1ccccc1Cl 62a_100000210623_100000764095 [0,1,1,0,0,0|2,0,0]=4 328 B11R1.17 C=CCSc1ccccc1Cl 62a_100000764095_100000210623 [0,1,1,0,0,0|2,0,0]=4 329 B11R1.17 C=CCSc1ccccc1F 62a_100000210623_100011215700 [0,1,1,0,0,0|2,0,0]=4 330 B11R1.17 C=CCSc1ccccc1F 62a_100011215700_100000210623 [0,1,1,0,0,0|2,0,0]=4 331 B11R1.17 C=CCSc1ccccc1N 62a_100000210017_100000210623 [0,1,1,0,0,0|1,0,0]=3 332 B11R1.17 C=CCSc1ccccc1N 62a_100000210623_100000210017 [0,1,1,0,0,0|1,0,0]=3 333 B11R1.17 C=CCSc1ccccc1O 62a_100000210623_100000739446 [0,1,1,0,0,0|2,0,0]=4 334 B11R1.17 C=CCSc1ccccc1O 62a_100000739446_100000210623 [0,1,1,0,0,0|2,0,0]=4 335 B11R1.17 C=CCSc1cccnc1N 62a_100000045569_100000210623 [0,1,1,0,0,0|2,0,0]=4 336 B11R1.17 C=CCSc1cccnc1N 62a_100000210623_100000045569 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.17 C=CCSc1ccncc1N 62a_100000210623_100000756074 [0,1,1,0,0,0|2,0,0]=4 338 B11R1.17 C=CCSc1ccncc1N 62a_100000756074_100000210623 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.17 C=CCSc1cnccc1N 62a_100000047001_100000210623 [0,1,1,0,0,0|2,0,0]=4 340 B11R1.17 C=CCSc1cnccc1N 62a_100000210623_100000047001 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.17 C=CCSc1ncccc1N 62a_100000210623_100000688686 [0,1,1,0,0,0|2,0,0]=4 342 B11R1.17 C=CCSc1ncccc1N 62a_100000688686_100000210623 [0,1,1,0,0,0|2,0,0]=4 343 B11R1.17 CC=NNc1ccccc1Br 4a_100000241748_200000210099 [0,1,1,0,0,0|2,0,0]=4 344 B11R1.17 CC=NNc1ccccc1C 4a_100000184220_200000210099 [0,1,1,0,0,0|2,0,0]=4 345 B11R1.17 CC=NNc1ccccc1Cl 4a_100000683529_200000210099 [0,1,1,0,0,0|2,0,0]=4 346 B11R1.17 CC=NNc1ccccc1F 4a_100000239246_200000210099 [0,1,1,0,0,0|2,0,0]=4 347 B11R1.17 CC=NNc1ccccc1I 4a_100011218156_200000210099 [0,1,1,0,0,0|2,0,0]=4 348 B11R1.17 CCCSc1ccccc1N 62a_100000210017_100000210303 [0,1,1,0,0,0|1,0,1]=4 349 B11R1.17 CCCSc1ccccc1N 62a_100000210303_100000210017 [0,1,1,0,0,0|1,0,1]=4 350 B11R1.17 COCSc1ccccc1N 62a_100000210017_100000766300 [0,1,1,0,0,0|0,1,1]=4 351 B11R1.17 COCSc1ccccc1N 62a_100000766300_100000210017 [0,1,1,0,0,0|0,1,1]=4 352 B11R1.17 CSCSc1ccccc1N 62a_100000210017_100011218213 [0,1,1,0,0,0|0,0,2]=4 353 B11R1.17 CSCSc1ccccc1N 62a_100011218213_100000210017 [0,1,1,0,0,0|0,0,2]=4 354 B11R1.17 Cc1ccccc1NCC=O 34a_100015192222_200009817547 [0,1,1,0,0,0|1,1,0]=4 355 B11R1.17 Cc1ccccc1SCC=O 62a_100000210755_200015260668 [0,1,1,0,0,0|1,1,0]=4 356 B11R1.17 Cc1ccccc1SCC=O 62a_200015260668_100000210755 [0,1,1,0,0,0|1,1,0]=4 357 B11R1.17 N#CCSc1ccccc1N 62a_100000210017_100011215382 [0,1,1,0,0,0|1,0,1]=4 358 B11R1.17 N#CCSc1ccccc1N 62a_100011215382_100000210017 [0,1,1,0,0,0|1,0,1]=4 359 B11R1.17 Nc1ccccc1OCC=O 34a_100000185747_200009817547 [0,1,1,0,0,0|0,2,0]=4 360 B11R1.17 Nc1ccccc1OCC=O 7a_100000185747_200015260668 [0,1,1,0,0,0|0,2,0]=4 361 B11R1.17 Nc1ccccc1SCC=O 62a_100000210017_200015260668 [0,1,1,0,0,0|0,1,0]=3 362 B11R1.17 Nc1ccccc1SCC=O 62a_200015260668_100000210017 [0,1,1,0,0,0|0,1,0]=3 363 B11R1.17 Nc1ccccc1SCCF 62a_100000210017_100011217306 [0,1,1,0,0,0|1,0,1]=4 364 B11R1.17 Nc1ccccc1SCCF 62a_100011217306_100000210017 [0,1,1,0,0,0|1,0,1]=4 365 B11R1.17 Nc1ccccc1SCCO 62a_100000210017_100000211926 [0,1,1,0,0,0|0,1,1]=4 366 B11R1.17 Nc1ccccc1SCCO 62a_100000211926_100000210017 [0,1,1,0,0,0|0,1,1]=4 367 B11R1.17 Nc1cccnc1SCC=O 62a_100000688686_200015260668 [0,1,1,0,0,0|1,1,0]=4 368 B11R1.17 Nc1cccnc1SCC=O 62a_200015260668_100000688686 [0,1,1,0,0,0|1,1,0]=4 369 B11R1.17 Nc1ccncc1SCC=O 62a_100000047001_200015260668 [0,1,1,0,0,0|1,1,0]=4 370 B11R1.17 Nc1ccncc1SCC=O 62a_200015260668_100000047001 [0,1,1,0,0,0|1,1,0]=4 371 B11R1.17 Nc1cnccc1SCC=O 62a_100000756074_200015260668 [0,1,1,0,0,0|1,1,0]=4 372 B11R1.17 Nc1cnccc1SCC=O 62a_200015260668_100000756074 [0,1,1,0,0,0|1,1,0]=4 373 B11R1.17 Nc1ncccc1SCC=O 62a_100000045569_200015260668 [0,1,1,0,0,0|1,1,0]=4 374 B11R1.17 Nc1ncccc1SCC=O 62a_200015260668_100000045569 [0,1,1,0,0,0|1,1,0]=4 375 B11R1.17 O=CCNc1ccccc1Br 34a_100000210017_200009817547 [0,1,1,0,0,0|1,1,0]=4 376 B11R1.17 O=CCNc1ccccc1Cl 34a_100000185783_200009817547 [0,1,1,0,0,0|1,1,0]=4 377 B11R1.17 O=CCNc1ccccc1F 34a_100000210422_200009817547 [0,1,1,0,0,0|1,1,0]=4 378 B11R1.17 O=CCNc1ccccc1I 34a_100000210053_200009817547 [0,1,1,0,0,0|1,1,0]=4 379 B11R1.17 O=CCNc1ccccc1O 34a_100000185747_200009817547 [0,1,1,0,0,0|0,2,0]=4 380 B11R1.17 O=CCSc1ccccc1Br 62a_100000695589_200015260668 [0,1,1,0,0,0|1,1,0]=4 381 B11R1.17 O=CCSc1ccccc1Br 62a_200015260668_100000695589 [0,1,1,0,0,0|1,1,0]=4 382 B11R1.17 O=CCSc1ccccc1Cl 62a_100000764095_200015260668 [0,1,1,0,0,0|1,1,0]=4 383 B11R1.17 O=CCSc1ccccc1Cl 62a_200015260668_100000764095 [0,1,1,0,0,0|1,1,0]=4 384 B11R1.17 O=CCSc1ccccc1F 62a_100011215700_200015260668 [0,1,1,0,0,0|1,1,0]=4 385 B11R1.17 O=CCSc1ccccc1F 62a_200015260668_100011215700 [0,1,1,0,0,0|1,1,0]=4 386 B11R1.17 O=CCSc1ccccc1O 62a_100000739446_200015260668 [0,1,1,0,0,0|1,1,0]=4 387 B11R1.17 O=CCSc1ccccc1O 62a_200015260668_100000739446 [0,1,1,0,0,0|1,1,0]=4 388 B11R1.41 C=CCc1ccccc1NC 2230a_200138433279_200000210301 [0,1,1,0,0,0|2,0,0]=4 389 B11R1.41 C=CCc1ccccc1NC 34a_200138433279_200000210301 [0,1,1,0,0,0|2,0,0]=4 390 B11R1.41 C=CCc1ccccc1N[13CH3] 2230a_200138433279_200025704644 [0,1,1,0,0,0|2,0,0]=4 391 B11R1.41 C=CCc1ccccc1N[13CH3] 34a_200138433279_200025704644 [0,1,1,0,0,0|2,0,0]=4 392 B11R1.41 C=CCc1ccccc1SC 62a_100009828059_200000210301 [0,1,1,0,0,0|2,0,0]=4 393 B11R1.41 C=CCc1ccccc1SC 62a_200000210301_100009828059 [0,1,1,0,0,0|2,0,0]=4 394 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_100009828059_200025704644 [0,1,1,0,0,0|2,0,0]=4 395 B11R1.41 C=CCc1ccccc1S[13CH3] 62a_200025704644_100009828059 [0,1,1,0,0,0|2,0,0]=4 396 B11R1.41 CC=Cc1ccccc1CN 271570a_100016259895_100000689332 [0,1,1,0,0,0|2,0,0]=4 397 B11R1.41 CC=Cc1ccccc1NC 271570a_100016259895_100020606079 [0,1,1,0,0,0|2,0,0]=4 398 B11R1.41 CC=Cc1ccccc1NN 271570a_100016259895_100000241748 [0,1,1,0,0,0|2,0,0]=4 399 B11R1.41 CC=Cc1ccccc1SC 271570a_100016259895_100011217816 [0,1,1,0,0,0|2,0,0]=4 400 B11R1.41 CCNc1ccccc1SC 34a_100000211160_100000210202 [0,1,1,0,0,0|1,0,1]=4 401 B11R1.41 CCNc1ccccc1SC 62a_114873767003_200000210301 [0,1,1,0,0,0|1,0,1]=4 402 B11R1.41 CCNc1ccccc1SC 62a_200000210301_114873767003 [0,1,1,0,0,0|1,0,1]=4 403 B11R1.41 CCNc1ccccc1S[13CH3] 62a_114873767003_200025704644 [0,1,1,0,0,0|1,0,1]=4 404 B11R1.41 CCNc1ccccc1S[13CH3] 62a_200025704644_114873767003 [0,1,1,0,0,0|1,0,1]=4 405 B11R1.41 CCSc1ccccc1CN 62a_100000210202_100000689332 [0,1,1,0,0,0|1,0,1]=4 406 B11R1.41 CCSc1ccccc1CN 62a_100000689332_100000210202 [0,1,1,0,0,0|1,0,1]=4 407 B11R1.41 CCSc1ccccc1NC 34a_100011223125_200000210301 [0,1,1,0,0,0|1,0,1]=4 408 B11R1.41 CCSc1ccccc1NC 62a_100000210202_100020606079 [0,1,1,0,0,0|1,0,1]=4 409 B11R1.41 CCSc1ccccc1NC 62a_100020606079_100000210202 [0,1,1,0,0,0|1,0,1]=4 410 B11R1.41 CCSc1ccccc1NN 62a_100000210202_100000241748 [0,1,1,0,0,0|1,0,1]=4 411 B11R1.41 CCSc1ccccc1NN 62a_100000241748_100000210202 [0,1,1,0,0,0|1,0,1]=4 412 B11R1.41 CCSc1ccccc1N[13CH3] 34a_100011223125_200025704644 [0,1,1,0,0,0|1,0,1]=4 413 B11R1.41 CNc1ccccc1SCF 62a_100015361967_100020606079 [0,1,1,0,0,0|1,0,1]=4 414 B11R1.41 CNc1ccccc1SCF 62a_100020606079_100015361967 [0,1,1,0,0,0|1,0,1]=4 415 B11R1.41 CSc1ccccc1NC#N 62a_200000210301_100011685340 [0,1,1,0,0,0|1,0,1]=4 416 B11R1.41 CSc1ccccc1NC=O 62a_200000210301_200020615051 [0,1,1,0,0,0|0,1,0]=3 417 B11R1.41 CSc1ccccc1NC=O 62a_200020615051_200000210301 [0,1,1,0,0,0|0,1,0]=3 418 B11R1.41 CSc1ccccc1NCF 34a_100000211160_100015361967 [0,1,1,0,0,0|1,0,1]=4 419 B11R1.41 NCc1ccccc1SCF 62a_100000689332_100015361967 [0,1,1,0,0,0|1,0,1]=4 420 B11R1.41 NCc1ccccc1SCF 62a_100015361967_100000689332 [0,1,1,0,0,0|1,0,1]=4 421 B11R1.41 NNc1ccccc1SCF 62a_100000241748_100015361967 [0,1,1,0,0,0|1,0,1]=4 422 B11R1.41 NNc1ccccc1SCF 62a_100015361967_100000241748 [0,1,1,0,0,0|1,0,1]=4 423 B11R1.41 [13CH3]Sc1ccccc1NC#N 62a_200025704644_100011685340 [0,1,1,0,0,0|1,0,1]=4 424 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200020615051_200025704644 [0,1,1,0,0,0|0,1,0]=3 425 B11R1.41 [13CH3]Sc1ccccc1NC=O 62a_200025704644_200020615051 [0,1,1,0,0,0|0,1,0]=3 426 B11R1.81 CC=Cc1ccc(cc1N)Br 271570a_100016259895_100000743836 [0,1,1,0,0,0|2,0,0]=4 427 B11R1.81 CC=Cc1ccc(cc1N)C 271570a_100016259895_100011216686 [0,1,1,0,0,0|2,0,0]=4 428 B11R1.81 CC=Cc1ccc(cc1N)Cl 271570a_100016259895_100000761886 [0,1,1,0,0,0|2,0,0]=4 429 B11R1.81 CC=Cc1ccc(cc1N)F 271570a_100016259895_100011218093 [0,1,1,0,0,0|2,0,0]=4 430 B11R1.81 CC=Cc1ccc(cc1N)N 271570a_100016259895_200012175722 [0,1,1,0,0,0|2,0,0]=4 431 B11R1.81 CC=Cc1ccc(cc1N)O 271570a_100016259895_100011999798 [0,1,1,0,0,0|2,0,0]=4 432 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000210202_100000743836 [0,1,1,0,0,0|1,0,1]=4 433 B11R1.81 CCSc1ccc(cc1N)Br 62a_100000743836_100000210202 [0,1,1,0,0,0|1,0,1]=4 434 B11R1.81 CCSc1ccc(cc1N)C 62a_100000210202_100011216686 [0,1,1,0,0,0|1,0,1]=4 435 B11R1.81 CCSc1ccc(cc1N)C 62a_100011216686_100000210202 [0,1,1,0,0,0|1,0,1]=4 436 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000210202_100000761886 [0,1,1,0,0,0|1,0,1]=4 437 B11R1.81 CCSc1ccc(cc1N)Cl 62a_100000761886_100000210202 [0,1,1,0,0,0|1,0,1]=4 438 B11R1.81 CCSc1ccc(cc1N)F 62a_100000210202_100000687223 [0,1,1,0,0,0|1,0,1]=4 439 B11R1.81 CCSc1ccc(cc1N)F 62a_100000687223_100000210202 [0,1,1,0,0,0|1,0,1]=4 440 B11R1.81 CCSc1ccc(cc1N)N 62a_100000210202_200012175722 [0,1,1,0,0,0|1,0,1]=4 441 B11R1.81 CCSc1ccc(cc1N)N 62a_200012175722_100000210202 [0,1,1,0,0,0|1,0,1]=4 442 B11R1.81 CCSc1ccc(cc1N)O 62a_100000210202_100011999798 [0,1,1,0,0,0|1,0,1]=4 443 B11R1.81 CCSc1ccc(cc1N)O 62a_100011999798_100000210202 [0,1,1,0,0,0|1,0,1]=4 444 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100011216686_100015361967 [0,1,1,0,0,0|1,0,1]=4 445 B11R1.81 Cc1ccc(c(c1)N)SCF 62a_100015361967_100011216686 [0,1,1,0,0,0|1,0,1]=4 446 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100000743836_100015361967 [0,1,1,0,0,0|1,0,1]=4 447 B11R1.81 Nc1cc(ccc1SCF)Br 62a_100015361967_100000743836 [0,1,1,0,0,0|1,0,1]=4 448 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100000761886_100015361967 [0,1,1,0,0,0|1,0,1]=4 449 B11R1.81 Nc1cc(ccc1SCF)Cl 62a_100015361967_100000761886 [0,1,1,0,0,0|1,0,1]=4 450 B11R1.81 Nc1cc(ccc1SCF)F 62a_100000687223_100015361967 [0,1,1,0,0,0|1,0,1]=4 451 B11R1.81 Nc1cc(ccc1SCF)F 62a_100015361967_100000687223 [0,1,1,0,0,0|1,0,1]=4 452 B11R1.81 Nc1cc(ccc1SCF)O 62a_100011999798_100015361967 [0,1,1,0,0,0|1,0,1]=4 453 B11R1.81 Nc1cc(ccc1SCF)O 62a_100015361967_100011999798 [0,1,1,0,0,0|1,0,1]=4 454 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_100015361967_200012175722 [0,1,1,0,0,0|1,0,1]=4 455 B11R1.81 Nc1ccc(c(c1)N)SCF 62a_200012175722_100015361967 [0,1,1,0,0,0|1,0,1]=4 456 B11R1.86 CC(=Cc1ccccc1N)C 271570a_100102525489_100000210017 [0,1,1,0,0,0|2,0,0]=4 457 B11R1.86 CC(=O)Nc1ccccc1Br 11a_100000210017_100015343762 [0,1,1,0,0,0|1,1,0]=4 458 B11R1.86 CC(=O)Nc1ccccc1Br 1626a_100000210017_100015343762 [0,1,1,0,0,0|1,1,0]=4 459 B11R1.86 CC(=O)Nc1ccccc1C 11a_100015192222_100015343762 [0,1,1,0,0,0|1,1,0]=4 460 B11R1.86 CC(=O)Nc1ccccc1C 1626a_100015192222_100015343762 [0,1,1,0,0,0|1,1,0]=4 461 B11R1.86 CC(=O)Nc1ccccc1C 22a_100015192222_100000070787 [0,1,1,0,0,0|1,1,0]=4 462 B11R1.86 CC(=O)Nc1ccccc1C 527a_100015192222_100103153847 [0,1,1,0,0,0|1,1,0]=4 463 B11R1.86 CC(=O)Nc1ccccc1Cl 11a_100000185783_100015343762 [0,1,1,0,0,0|1,1,0]=4 464 B11R1.86 CC(=O)Nc1ccccc1Cl 1626a_100000185783_100015343762 [0,1,1,0,0,0|1,1,0]=4 465 B11R1.86 CC(=O)Nc1ccccc1Cl 22a_100000185783_100000070787 [0,1,1,0,0,0|1,1,0]=4 466 B11R1.86 CC(=O)Nc1ccccc1Cl 527a_100000185783_100103153847 [0,1,1,0,0,0|1,1,0]=4 467 B11R1.86 CC(=O)Nc1ccccc1F 11a_100000210422_100015343762 [0,1,1,0,0,0|1,1,0]=4 468 B11R1.86 CC(=O)Nc1ccccc1F 1626a_100000210422_100015343762 [0,1,1,0,0,0|1,1,0]=4 469 B11R1.86 CC(=O)Nc1ccccc1F 22a_100000210422_100000070787 [0,1,1,0,0,0|1,1,0]=4 470 B11R1.86 CC(=O)Nc1ccccc1F 527a_100000210422_100103153847 [0,1,1,0,0,0|1,1,0]=4 471 B11R1.86 CC(=O)Nc1ccccc1I 11a_100000210053_100015343762 [0,1,1,0,0,0|1,1,0]=4 472 B11R1.86 CC(=O)Nc1ccccc1I 1626a_100000210053_100015343762 [0,1,1,0,0,0|1,1,0]=4 473 B11R1.86 CC(=O)Nc1ccccc1O 22a_100000185747_100000070787 [0,1,1,0,0,0|0,2,0]=4 474 B11R1.86 CC(=O)Nc1ccccc1O 271570a_203496583355_100000153524 [0,1,1,0,0,0|0,2,0]=4 475 B11R1.86 CC(=O)Nc1ccccc1O 527a_100000185747_100103153847 [0,1,1,0,0,0|0,2,0]=4 476 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210017_100000210206 [0,1,1,0,0,0|1,0,1]=4 477 B11R1.86 CC(C)Sc1ccccc1N 62a_100000210206_100000210017 [0,1,1,0,0,0|1,0,1]=4 478 B11R1.86 NC(=O)Nc1ccccc1O 271570a_203496583355_100000742221 [0,1,1,0,0,0|0,2,0]=4 479 B11R1.182 CC=Cc1cc(ccc1N)Br 271570a_100016259895_100000187925 [0,1,1,0,0,0|2,0,0]=4 480 B11R1.182 CC=Cc1cc(ccc1N)C 271570a_100016259895_100000210942 [0,1,1,0,0,0|2,0,0]=4 481 B11R1.182 CC=Cc1cc(ccc1N)Cl 271570a_100016259895_100000761889 [0,1,1,0,0,0|2,0,0]=4 482 B11R1.182 CC=Cc1cc(ccc1N)F 271570a_100016259895_100000760547 [0,1,1,0,0,0|2,0,0]=4 483 B11R1.182 CC=Cc1cc(ccc1N)N 271570a_100016259895_100011534242 [0,1,1,0,0,0|2,0,0]=4 484 B11R1.182 CC=Cc1cc(ccc1N)O 271570a_100016259895_100012001276 [0,1,1,0,0,0|2,0,0]=4 485 B11R1.182 CCSc1cc(ccc1N)Br 62a_100000187925_100000210202 [0,1,1,0,0,0|1,0,1]=4 486 B11R1.182 CCSc1cc(ccc1N)Br 62a_100000210202_100000187925 [0,1,1,0,0,0|1,0,1]=4 487 B11R1.182 CCSc1cc(ccc1N)C 62a_100000210202_100011356834 [0,1,1,0,0,0|1,0,1]=4 488 B11R1.182 CCSc1cc(ccc1N)C 62a_100011356834_100000210202 [0,1,1,0,0,0|1,0,1]=4 489 B11R1.182 CCSc1cc(ccc1N)Cl 62a_100000210202_100000761889 [0,1,1,0,0,0|1,0,1]=4 490 B11R1.182 CCSc1cc(ccc1N)Cl 62a_100000761889_100000210202 [0,1,1,0,0,0|1,0,1]=4 491 B11R1.182 CCSc1cc(ccc1N)F 62a_100000210202_100000760547 [0,1,1,0,0,0|1,0,1]=4 492 B11R1.182 CCSc1cc(ccc1N)F 62a_100000760547_100000210202 [0,1,1,0,0,0|1,0,1]=4 493 B11R1.182 CCSc1cc(ccc1N)N 62a_100000210202_100011534242 [0,1,1,0,0,0|1,0,1]=4 494 B11R1.182 CCSc1cc(ccc1N)N 62a_100011534242_100000210202 [0,1,1,0,0,0|1,0,1]=4 495 B11R1.182 CCSc1cc(ccc1N)O 62a_100000210202_100012001276 [0,1,1,0,0,0|1,0,1]=4 496 B11R1.182 CCSc1cc(ccc1N)O 62a_100012001276_100000210202 [0,1,1,0,0,0|1,0,1]=4 497 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100011356834_100015361967 [0,1,1,0,0,0|1,0,1]=4 498 B11R1.182 Cc1ccc(c(c1)SCF)N 62a_100015361967_100011356834 [0,1,1,0,0,0|1,0,1]=4 499 B11R1.182 Nc1ccc(c(c1)SCF)N 62a_100011534242_100015361967 [0,1,1,0,0,0|1,0,1]=4 500 B11R1.182 Nc1ccc(c(c1)SCF)N 62a_100015361967_100011534242 [0,1,1,0,0,0|1,0,1]=4 501 B11R1.182 Nc1ccc(cc1SCF)Br 62a_100000187925_100015361967 [0,1,1,0,0,0|1,0,1]=4 502 B11R1.182 Nc1ccc(cc1SCF)Br 62a_100015361967_100000187925 [0,1,1,0,0,0|1,0,1]=4 503 B11R1.182 Nc1ccc(cc1SCF)Cl 62a_100000761889_100015361967 [0,1,1,0,0,0|1,0,1]=4 504 B11R1.182 Nc1ccc(cc1SCF)Cl 62a_100015361967_100000761889 [0,1,1,0,0,0|1,0,1]=4 505 B11R1.182 Nc1ccc(cc1SCF)F 62a_100000760547_100015361967 [0,1,1,0,0,0|1,0,1]=4 506 B11R1.182 Nc1ccc(cc1SCF)F 62a_100015361967_100000760547 [0,1,1,0,0,0|1,0,1]=4 507 B11R1.182 Nc1ccc(cc1SCF)O 62a_100012001276_100015361967 [0,1,1,0,0,0|1,0,1]=4 508 B11R1.182 Nc1ccc(cc1SCF)O 62a_100015361967_100012001276 [0,1,1,0,0,0|1,0,1]=4 509 B11R1.605 CC=Cc1c(cccc1Br)N 271570a_100016259895_100020590159 [0,1,1,0,0,0|2,0,0]=4 510 B11R1.605 CC=Cc1c(cccc1Cl)N 271570a_100016259895_100000049713 [0,1,1,0,0,0|2,0,0]=4 511 B11R1.605 CC=Cc1c(cccc1F)N 271570a_100016259895_100011934729 [0,1,1,0,0,0|2,0,0]=4 512 B11R1.605 CC=Cc1c(cccc1N)C 271570a_100016259895_100000684715 [0,1,1,0,0,0|2,0,0]=4 513 B11R1.605 CC=Cc1c(cccc1O)N 271570a_100016259895_100012183704 [0,1,1,0,0,0|2,0,0]=4 514 B11R1.605 CCSc1c(cccc1Br)N 62a_100000210202_100020590159 [0,1,1,0,0,0|1,0,1]=4 515 B11R1.605 CCSc1c(cccc1Br)N 62a_100020590159_100000210202 [0,1,1,0,0,0|1,0,1]=4 516 B11R1.605 CCSc1c(cccc1Cl)N 62a_100000049713_100000210202 [0,1,1,0,0,0|1,0,1]=4 517 B11R1.605 CCSc1c(cccc1Cl)N 62a_100000210202_100000049713 [0,1,1,0,0,0|1,0,1]=4 518 B11R1.605 CCSc1c(cccc1F)N 62a_100000210202_100000690935 [0,1,1,0,0,0|1,0,1]=4 519 B11R1.605 CCSc1c(cccc1F)N 62a_100000690935_100000210202 [0,1,1,0,0,0|1,0,1]=4 520 B11R1.605 CCSc1c(cccc1N)C 62a_100000210202_100000684715 [0,1,1,0,0,0|1,0,1]=4 521 B11R1.605 CCSc1c(cccc1N)C 62a_100000684715_100000210202 [0,1,1,0,0,0|1,0,1]=4 522 B11R1.605 CCSc1c(cccc1O)N 62a_100000210202_100012183704 [0,1,1,0,0,0|1,0,1]=4 523 B11R1.605 CCSc1c(cccc1O)N 62a_100012183704_100000210202 [0,1,1,0,0,0|1,0,1]=4 524 B11R1.605 Cc1cccc(c1SCF)N 62a_100000684715_100015361967 [0,1,1,0,0,0|1,0,1]=4 525 B11R1.605 Cc1cccc(c1SCF)N 62a_100015361967_100000684715 [0,1,1,0,0,0|1,0,1]=4 526 B11R1.605 Nc1cccc(c1SCF)Br 62a_100015361967_100020590159 [0,1,1,0,0,0|1,0,1]=4 527 B11R1.605 Nc1cccc(c1SCF)Br 62a_100020590159_100015361967 [0,1,1,0,0,0|1,0,1]=4 528 B11R1.605 Nc1cccc(c1SCF)Cl 62a_100000049713_100015361967 [0,1,1,0,0,0|1,0,1]=4 529 B11R1.605 Nc1cccc(c1SCF)Cl 62a_100015361967_100000049713 [0,1,1,0,0,0|1,0,1]=4 530 B11R1.605 Nc1cccc(c1SCF)F 62a_100000690935_100015361967 [0,1,1,0,0,0|1,0,1]=4 531 B11R1.605 Nc1cccc(c1SCF)F 62a_100015361967_100000690935 [0,1,1,0,0,0|1,0,1]=4 532 B11R1.605 Nc1cccc(c1SCF)O 62a_100012183704_100015361967 [0,1,1,0,0,0|1,0,1]=4 533 B11R1.605 Nc1cccc(c1SCF)O 62a_100015361967_100012183704 [0,1,1,0,0,0|1,0,1]=4 534 B11R1.20 CC(=O)Nc1ccc(cc1)Br 11a_100000210018_100015343762 [0,1,1,0,0,0|1,1,0]=4 535 B11R1.20 CC(=O)Nc1ccc(cc1)Br 1626a_100000210018_100015343762 [0,1,1,0,0,0|1,1,0]=4 536 B11R1.20 CC(=O)Nc1ccc(cc1)Br 22a_100000210018_100000070787 [0,1,1,0,0,0|1,1,0]=4 537 B11R1.20 CC(=O)Nc1ccc(cc1)Br 527a_100000210018_100103153847 [0,1,1,0,0,0|1,1,0]=4 538 B11R1.20 CC(=O)Nc1ccc(cc1)C 11a_100000124888_100015343762 [0,1,1,0,0,0|1,1,0]=4 539 B11R1.20 CC(=O)Nc1ccc(cc1)C 1626a_100000124888_100015343762 [0,1,1,0,0,0|1,1,0]=4 540 B11R1.20 CC(=O)Nc1ccc(cc1)C 22a_100000124888_100000070787 [0,1,1,0,0,0|1,1,0]=4 541 B11R1.20 CC(=O)Nc1ccc(cc1)C 527a_100000124888_100103153847 [0,1,1,0,0,0|1,1,0]=4 542 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 11a_100000210052_100015343762 [0,1,1,0,0,0|1,1,0]=4 543 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 1626a_100000210052_100015343762 [0,1,1,0,0,0|1,1,0]=4 544 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 22a_100000210052_100000070787 [0,1,1,0,0,0|1,1,0]=4 545 B11R1.20 CC(=O)Nc1ccc(cc1)Cl 527a_100000210052_100103153847 [0,1,1,0,0,0|1,1,0]=4 546 B11R1.20 CC(=O)Nc1ccc(cc1)F 11a_100000185862_100015343762 [0,1,1,0,0,0|1,1,0]=4 547 B11R1.20 CC(=O)Nc1ccc(cc1)F 1626a_100000185862_100015343762 [0,1,1,0,0,0|1,1,0]=4 548 B11R1.20 CC(=O)Nc1ccc(cc1)F 22a_100000185862_100000070787 [0,1,1,0,0,0|1,1,0]=4 549 B11R1.20 CC(=O)Nc1ccc(cc1)F 527a_100000185862_100103153847 [0,1,1,0,0,0|1,1,0]=4 550 B11R1.20 CC(=O)Nc1ccc(cc1)I 11a_100000185761_100015343762 [0,1,1,0,0,0|1,1,0]=4 551 B11R1.20 CC(=O)Nc1ccc(cc1)I 1626a_100000185761_100015343762 [0,1,1,0,0,0|1,1,0]=4 552 B11R1.20 CC(=O)Nc1ccc(cc1)I 22a_100000185761_100000070787 [0,1,1,0,0,0|1,1,0]=4 553 B11R1.20 CC(=O)Nc1ccc(cc1)I 527a_100000185761_100103153847 [0,1,1,0,0,0|1,1,0]=4 554 B11R1.20 CC(=O)Nc1ccc(cc1)O 22a_100000185829_100000070787 [0,1,1,0,0,0|1,1,0]=4 555 B11R1.20 CC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000155215 [0,1,1,0,0,0|1,1,0]=4 556 B11R1.20 CC(=O)Sc1ccc(cc1)O 271570a_203496583355_200009995050 [0,1,1,0,0,0|1,1,0]=4 557 B11R1.20 CC(=S)Oc1ccc(cc1)O 271570a_203496583355_200009816735 [0,1,1,0,0,0|1,1,0]=4 558 B11R1.20 NC(=O)Cc1ccc(cc1)O 271570a_203496583355_100000162331 [0,1,1,0,0,0|1,1,0]=4 559 B11R1.20 NC(=O)Nc1ccc(cc1)O 271570a_203496583355_100000198584 [0,1,1,0,0,0|1,1,0]=4 560 B11R1.36 CC(=O)N(C)c1ccccc1 11a_100000210012_100015343762 [0,1,1,0,0,0|1,1,0]=4 561 B11R1.36 CC(=O)N(C)c1ccccc1 1626a_100000210012_100015343762 [0,1,1,0,0,0|1,1,0]=4 562 B11R1.36 CC(=O)N(C)c1ccccc1 22a_100000210012_100000070787 [0,1,1,0,0,0|1,1,0]=4 563 B11R1.40 C=CC(=O)Nc1ccccc1 1626a_100000106764_100000185746 [0,1,1,0,0,0|1,1,0]=4 564 B11R1.40 C=CC(=O)Nc1ccccc1 22a_100000106764_100000185746 [0,1,1,0,0,0|1,1,0]=4 565 B11R1.40 CCC(=O)Nc1ccccc1 11a_100000106764_100000210414 [0,1,1,0,0,0|1,1,0]=4 566 B11R1.40 CCC(=O)Nc1ccccc1 1626a_100000106764_100000210414 [0,1,1,0,0,0|1,1,0]=4 567 B11R1.40 CCC(=O)Nc1ccccc1 22a_100000106764_100000210414 [0,1,1,0,0,0|1,1,0]=4 568 B11R1.40 CCC(=O)Nc1ccccc1 527a_100000106764_100000210414 [0,1,1,0,0,0|1,1,0]=4 569 B11R1.40 CNC(=O)Nc1ccccc1 2430a_100000106764_100102657272 [0,1,1,0,0,0|1,1,0]=4 570 B11R1.40 O=C(CO)Nc1ccccc1 22a_100000106764_100000210174 [0,1,1,0,0,0|0,2,0]=4 571 B11R1.40 O=C(CO)Nc1ccccc1 527a_100000106764_100000210174 [0,1,1,0,0,0|0,2,0]=4 572 B11R1.157 CC(=O)Nc1cccc(c1)Br 11a_100000210019_100015343762 [0,1,1,0,0,0|1,1,0]=4 573 B11R1.157 CC(=O)Nc1cccc(c1)Br 1626a_100000210019_100015343762 [0,1,1,0,0,0|1,1,0]=4 574 B11R1.157 CC(=O)Nc1cccc(c1)Br 22a_100000210019_100000070787 [0,1,1,0,0,0|1,1,0]=4 575 B11R1.157 CC(=O)Nc1cccc(c1)Br 527a_100000210019_100103153847 [0,1,1,0,0,0|1,1,0]=4 576 B11R1.157 CC(=O)Nc1cccc(c1)C 11a_100000188690_100015343762 [0,1,1,0,0,0|1,1,0]=4 577 B11R1.157 CC(=O)Nc1cccc(c1)C 1626a_100000188690_100015343762 [0,1,1,0,0,0|1,1,0]=4 578 B11R1.157 CC(=O)Nc1cccc(c1)C 22a_100000188690_100000070787 [0,1,1,0,0,0|1,1,0]=4 579 B11R1.157 CC(=O)Nc1cccc(c1)C 527a_100000188690_100103153847 [0,1,1,0,0,0|1,1,0]=4 580 B11R1.157 CC(=O)Nc1cccc(c1)Cl 11a_100000185859_100015343762 [0,1,1,0,0,0|1,1,0]=4 581 B11R1.157 CC(=O)Nc1cccc(c1)Cl 1626a_100000185859_100015343762 [0,1,1,0,0,0|1,1,0]=4 582 B11R1.157 CC(=O)Nc1cccc(c1)Cl 22a_100000185859_100000070787 [0,1,1,0,0,0|1,1,0]=4 583 B11R1.157 CC(=O)Nc1cccc(c1)F 11a_100000210047_100015343762 [0,1,1,0,0,0|1,1,0]=4 584 B11R1.157 CC(=O)Nc1cccc(c1)F 1626a_100000210047_100015343762 [0,1,1,0,0,0|1,1,0]=4 585 B11R1.157 CC(=O)Nc1cccc(c1)F 22a_100000210047_100000070787 [0,1,1,0,0,0|1,1,0]=4 586 B11R1.157 CC(=O)Nc1cccc(c1)F 527a_100000210047_100103153847 [0,1,1,0,0,0|1,1,0]=4 587 B11R1.157 CC(=O)Nc1cccc(c1)I 11a_100000211102_100015343762 [0,1,1,0,0,0|1,1,0]=4 588 B11R1.157 CC(=O)Nc1cccc(c1)I 1626a_100000211102_100015343762 [0,1,1,0,0,0|1,1,0]=4 589 B11R1.157 CC(=O)Nc1cccc(c1)I 22a_100000211102_100000070787 [0,1,1,0,0,0|1,1,0]=4 590 B11R1.157 CC(=O)Nc1cccc(c1)I 527a_100000211102_100103153847 [0,1,1,0,0,0|1,1,0]=4 591 B11R1.157 CC(=O)Nc1cccc(c1)O 1626a_100000210217_100015343762 [0,1,1,0,0,0|1,1,0]=4 592 B11R1.157 CC(=O)Nc1cccc(c1)O 22a_100000210217_100000070787 [0,1,1,0,0,0|1,1,0]=4 593 B11R1.157 CC(=O)Nc1cccc(c1)O 271570a_203496583355_100000153616 [0,1,1,0,0,0|1,1,0]=4 594 B11R1.157 CC(=O)Nc1cccc(c1)O 527a_100000210217_100103153847 [0,1,1,0,0,0|1,1,0]=4 595 B11R1.157 NC(=O)Cc1cccc(c1)O 271570a_203496583355_100011586816 [0,1,1,0,0,0|1,1,0]=4 596 B11R1.157 NC(=O)Nc1cccc(c1)O 271570a_203496583355_100000238923 [0,1,1,0,0,0|1,1,0]=4 597 B11R2.1 Oc1c[nH]c2c1cccn2 271570a_203496583355_100011934613 [1,1,0,0,0,0|2,0,0]=4 598 B11R2.1 Oc1c[nH]c2c1ccnc2 271570a_203496583355_100010232032 [1,1,0,0,0,0|2,0,0]=4 599 B11R2.1 Oc1c[nH]c2c1cncc2 271570a_203496583355_100011934843 [1,1,0,0,0,0|2,0,0]=4 600 B11R2.1 Oc1c[nH]c2c1nccc2 271570a_203496583355_100009817151 [1,1,0,0,0,0|2,0,0]=4 601 B11R2.1 Oc1coc2c1cccc2 271570a_203496583355_100009812202 [1,1,0,0,0,0|1,1,0]=4 602 B11R2.1 Oc1csc2c1cccc2 271570a_203496583355_100009813928 [1,1,0,0,0,0|1,0,0]=3 603 B11R2.1 Oc1csc2c1cccn2 271570a_203496583355_100009830249 [1,1,0,0,0,0|2,0,0]=4 604 B11R2.1 Oc1csc2c1ccnc2 271570a_203496583355_100009817111 [1,1,0,0,0,0|2,0,0]=4 605 B11R2.1 Oc1csc2c1cncc2 271570a_203496583355_100010247091 [1,1,0,0,0,0|2,0,0]=4 606 B11R2.1 Oc1csc2c1nccc2 271570a_203496583355_100010247092 [1,1,0,0,0,0|2,0,0]=4 607 B11R2.1 Oc1n[nH]c2c1cccc2 271570a_203496583355_100000050141 [1,1,0,0,0,0|2,0,0]=4 608 B11R2.36 Oc1cc2[nH]ccc2cn1 271570a_203496583355_100000089685 [1,1,0,0,0,0|2,0,0]=4 609 B11R2.36 Oc1cc2cc[nH]c2cn1 271570a_203496583355_100009864809 [1,1,0,0,0,0|2,0,0]=4 610 B11R2.36 Oc1cc2nc[nH]c2cn1 271570a_203496583355_100000070173 [1,1,0,0,0,0|2,0,0]=4 611 B11R2.36 Oc1cc2sccc2cn1 271570a_203496583355_200016184645 [1,1,0,0,0,0|2,0,0]=4 612 B11R2.36 Oc1ccc2[nH]ccc2c1 271570a_203496583355_100000211741 [1,1,0,0,0,0|1,0,0]=3 613 B11R2.36 Oc1ccc2[nH]ccc2n1 271570a_203496583355_100000087148 [1,1,0,0,0,0|2,0,0]=4 614 B11R2.36 Oc1ccc2[nH]cnc2c1 271570a_203496583355_100011265325 [1,1,0,0,0,0|1,0,0]=3 615 B11R2.36 Oc1ccc2[nH]ncc2c1 271570a_203496583355_100000049815 [1,1,0,0,0,0|2,0,0]=4 616 B11R2.36 Oc1ccc2c(c1)C=CC2 271570a_203496583355_100009814306 [1,1,0,0,0,0|2,0,0]=4 617 B11R2.36 Oc1ccc2c(c1)CC=C2 271570a_203496583355_200009818231 [1,1,0,0,0,0|2,0,0]=4 618 B11R2.36 Oc1ccc2c(c1)CCN2 271570a_203496583355_100000026929 [1,1,0,0,0,0|1,0,1]=4 619 B11R2.36 Oc1ccc2c(c1)NCC2 271570a_203496583355_100000754641 [1,1,0,0,0,0|1,0,1]=4 620 B11R2.36 Oc1ccc2cc[nH]c2c1 271570a_203496583355_100000743809 [1,1,0,0,0,0|1,0,0]=3 621 B11R2.36 Oc1ccc2cc[nH]c2n1 271570a_203496583355_100009814870 [1,1,0,0,0,0|2,0,0]=4 622 B11R2.36 Oc1ccc2ccoc2c1 271570a_203496583355_100000759542 [1,1,0,0,0,0|1,1,0]=4 623 B11R2.36 Oc1ccc2ccsc2c1 271570a_203496583355_100009888917 [1,1,0,0,0,0|1,0,0]=3 624 B11R2.36 Oc1ccc2cn[nH]c2c1 271570a_203496583355_100000049514 [1,1,0,0,0,0|2,0,0]=4 625 B11R2.36 Oc1ccc2nc[nH]c2n1 271570a_203496583355_100000077665 [1,1,0,0,0,0|2,0,0]=4 626 B11R2.36 Oc1ccc2ncoc2c1 271570a_203496583355_100009817590 [1,1,0,0,0,0|0,1,1]=4 627 B11R2.36 Oc1ccc2ncsc2c1 271570a_203496583355_100009816678 [1,1,0,0,0,0|0,0,1]=3 628 B11R2.36 Oc1ccc2ncsc2n1 271570a_203496583355_100010381354 [1,1,0,0,0,0|1,0,1]=4 629 B11R2.36 Oc1ccc2nn[nH]c2c1 271570a_203496583355_100009817464 [1,1,0,0,0,0|2,0,0]=4 630 B11R2.36 Oc1ccc2occc2c1 271570a_203496583355_100012343831 [1,1,0,0,0,0|1,1,0]=4 631 B11R2.36 Oc1ccc2ocnc2c1 271570a_203496583355_100009816175 [1,1,0,0,0,0|0,1,1]=4 632 B11R2.36 Oc1ccc2sccc2c1 271570a_203496583355_100009814439 [1,1,0,0,0,0|1,0,0]=3 633 B11R2.36 Oc1ccc2sccc2n1 271570a_203496583355_100012000956 [1,1,0,0,0,0|2,0,0]=4 634 B11R2.36 Oc1ccc2scnc2c1 271570a_203496583355_100010005895 [1,1,0,0,0,0|0,0,1]=3 635 B11R2.36 Oc1cnc2[nH]ccc2c1 271570a_203496583355_100000760471 [1,1,0,0,0,0|2,0,0]=4 636 B11R2.36 Oc1cnc2cc[nH]c2c1 271570a_203496583355_100009818992 [1,1,0,0,0,0|2,0,0]=4 637 B11R2.36 Oc1cnc2nc[nH]c2c1 271570a_203496583355_100000760087 [1,1,0,0,0,0|2,0,0]=4 638 B11R2.36 Oc1cnc2sccc2c1 271570a_203496583355_100010135160 [1,1,0,0,0,0|2,0,0]=4 639 B11R2.36 Oc1cnc2scnc2c1 271570a_203496583355_100010178689 [1,1,0,0,0,0|1,0,1]=4 640 B11R2.106 Oc1cccc2c1CC=C2 271570a_203496583355_100009844718 [1,1,0,0,0,0|2,0,0]=4 641 B11R2.106 Oc1cccc2c1CCN2 271570a_203496583355_100009817896 [1,1,0,0,0,0|1,0,1]=4 642 B11R2.106 Oc1cccc2c1NCC2 271570a_203496583355_100016995435 [1,1,0,0,0,0|1,0,1]=4 643 B11R2.106 Oc1cccc2c1[nH]cc2 271570a_203496583355_100009813418 [1,1,0,0,0,0|1,0,0]=3 644 B11R2.106 Oc1cccc2c1[nH]nc2 271570a_203496583355_100009816125 [1,1,0,0,0,0|2,0,0]=4 645 B11R2.106 Oc1cccc2c1[nH]nn2 271570a_203496583355_100009820029 [1,1,0,0,0,0|2,0,0]=4 646 B11R2.106 Oc1cccc2c1cc[nH]2 271570a_203496583355_100000685724 [1,1,0,0,0,0|1,0,0]=3 647 B11R2.106 Oc1cccc2c1cco2 271570a_203496583355_100000756496 [1,1,0,0,0,0|1,1,0]=4 648 B11R2.106 Oc1cccc2c1ccs2 271570a_203496583355_100009816950 [1,1,0,0,0,0|1,0,0]=3 649 B11R2.106 Oc1cccc2c1cn[nH]2 271570a_203496583355_100000753301 [1,1,0,0,0,0|2,0,0]=4 650 B11R2.106 Oc1cccc2c1nc[nH]2 271570a_203496583355_100011935113 [1,1,0,0,0,0|1,0,0]=3 651 B11R2.106 Oc1cccc2c1nco2 271570a_203496583355_100009816834 [1,1,0,0,0,0|0,1,1]=4 652 B11R2.106 Oc1cccc2c1ncs2 271570a_203496583355_100000726125 [1,1,0,0,0,0|0,0,1]=3 653 B11R2.106 Oc1cccc2c1occ2 271570a_203496583355_100011935138 [1,1,0,0,0,0|1,1,0]=4 654 B11R2.106 Oc1cccc2c1ocn2 271570a_203496583355_100000728214 [1,1,0,0,0,0|0,1,1]=4 655 B11R2.106 Oc1cccc2c1scc2 271570a_203496583355_100000766737 [1,1,0,0,0,0|1,0,0]=3 656 B11R2.106 Oc1cccc2c1scn2 271570a_203496583355_100010246326 [1,1,0,0,0,0|0,0,1]=3 657 B11R2.106 Oc1ccnc2c1[nH]cc2 271570a_203496583355_100009863063 [1,1,0,0,0,0|2,0,0]=4 658 B11R2.106 Oc1ccnc2c1cc[nH]2 271570a_203496583355_100000049914 [1,1,0,0,0,0|2,0,0]=4 659 B11R2.106 Oc1ccnc2c1ccs2 271570a_203496583355_100009861243 [1,1,0,0,0,0|2,0,0]=4 660 B11R2.106 Oc1ccnc2c1nc[nH]2 271570a_203496583355_100009820729 [1,1,0,0,0,0|2,0,0]=4 661 B11R2.106 Oc1ccnc2c1scc2 271570a_203496583355_100000723842 [1,1,0,0,0,0|2,0,0]=4 662 B11R2.106 Oc1cncc2c1[nH]cc2 271570a_203496583355_100000217057 [1,1,0,0,0,0|2,0,0]=4 663 B11R2.106 Oc1cncc2c1[nH]cn2 271570a_203496583355_100000759552 [1,1,0,0,0,0|2,0,0]=4 664 B11R2.106 Oc1cncc2c1cc[nH]2 271570a_203496583355_100009840476 [1,1,0,0,0,0|2,0,0]=4 665 B11R2.106 Oc1nccc2c1[nH]cc2 271570a_203496583355_100009816714 [1,1,0,0,0,0|2,0,0]=4 666 B11R2.106 Oc1nccc2c1cc[nH]2 271570a_203496583355_100000086534 [1,1,0,0,0,0|2,0,0]=4 667 B11R2.106 Oc1nccc2c1ccs2 271570a_203496583355_100000047778 [1,1,0,0,0,0|2,0,0]=4 668 B11R2.106 Oc1nccc2c1nc[nH]2 271570a_203496583355_100009820035 [1,1,0,0,0,0|2,0,0]=4 669 B11R2.106 Oc1nccc2c1scc2 271570a_203496583355_100000117209 [1,1,0,0,0,0|2,0,0]=4 670 B13R2.32 O=c1c(c[nH]c2c1cccc2)O 271570a_203496583355_100012339567 [0,1,0,0,0,1|1,1,0]=4 671 B13R2.155 O=C1CCc2ccc(cc2N1)O 271570a_203496583355_100000763451 [0,1,0,0,0,1|1,1,0]=4 672 B13R2.155 O=C1COc2ccc(cc2N1)O 271570a_203496583355_100000244627 [0,1,0,0,0,1|0,2,0]=4 673 B13R2.155 O=C1CSc2ccc(cc2N1)O 271570a_203496583355_100012361575 [0,1,0,0,0,1|0,1,0]=3 674 B13R2.155 O=C1NCc2ccc(cc2N1)O 271570a_203496583355_100010161048 [0,1,0,0,0,1|1,1,0]=4 675 B13R2.155 O=C1Nc2cc(ccc2CO1)O 271570a_203496583355_100000726308 [0,1,0,0,0,1|0,2,0]=4 676 B13R2.162 O=c1ccc2cccc(c2[nH]1)O 271570a_203496583355_100000688906 [0,1,0,0,0,1|1,1,0]=4 677 B13R2.328 O=c1cc([nH]c2c1cccc2)O 271570a_203496583355_100000090176 [0,1,0,0,0,1|1,1,0]=4 678 B13R2.328 O=c1cc(c2ccccc2[nH]1)O 271570a_203496583355_100000075698 [0,1,0,0,0,1|1,1,0]=4 679 B13R2.3683 O=C1CCc2cc(ccc2N1)O 271570a_203496583355_100000754843 [0,1,0,0,0,1|1,1,0]=4 680 B13R2.3683 O=C1CNc2cc(ccc2N1)O 271570a_203496583355_100000693460 [0,1,0,0,0,1|1,1,0]=4 681 B13R2.3683 O=C1COc2cc(ccc2N1)O 271570a_203496583355_100000745508 [0,1,0,0,0,1|0,2,0]=4 682 B13R2.3683 O=C1CSc2cc(ccc2N1)O 271570a_203496583355_100011830382 [0,1,0,0,0,1|0,1,0]=3 683 B13R2.3683 O=C1Cc2ccc(cc2CN1)O 271570a_203496583355_100010174877 [0,1,0,0,0,1|1,1,0]=4 684 B13R2.3683 O=C1NCc2cc(ccc2N1)O 271570a_203496583355_100010171468 [0,1,0,0,0,1|1,1,0]=4 685 B13R2.3683 O=C1Nc2ccc(cc2CO1)O 271570a_203496583355_100010219366 [0,1,0,0,0,1|0,2,0]=4 686 B13R2.3683 O=c1ccc2cc(ccc2[nH]1)O 271570a_203496583355_100011934725 [0,1,0,0,0,1|1,1,0]=4 687 B13R2.3683 O=c1cnc2cc(ccc2[nH]1)O 271570a_203496583355_100010209493 [0,1,0,0,0,1|1,1,0]=4 688 B13R2.5179 O=C1CCc2c(cccc2N1)O 271570a_203496583355_100010232564 [0,1,0,0,0,1|1,1,0]=4 689 B13R2.5179 O=C1COc2c(cccc2N1)O 271570a_203496583355_100012355675 [0,1,0,0,0,1|0,2,0]=4 690 B13R2.5179 O=c1ccc2c(cccc2[nH]1)O 271570a_203496583355_100000726145 [0,1,0,0,0,1|1,1,0]=4 691 B13R2.45 C=Cc1nc2ccccc2n1C 271570a_100011290941_200000239431 [0,2,0,0,0,0|2,0,0]=4 692 B13R2.45 C=Cc1sc2ccccc2c1C 271570a_100011290941_200010198769 [0,2,0,0,0,0|2,0,0]=4 693 B13R2.45 CNc1nc2ccccc2n1C 27a_100102657272_200000239431 [0,2,0,0,0,0|2,0,0]=4 694 B13R2.45 COc1cc2ccccc2n1C 34a_100000066695_200000210301 [0,2,0,0,0,0|1,1,0]=4 695 B13R2.45 CSc1nc2ccccc2n1C 62a_200000210301_200000239431 [0,2,0,0,0,0|1,0,1]=4 696 B13R2.45 CSc1nc2ccccc2n1C 62a_200000239431_200000210301 [0,2,0,0,0,0|1,0,1]=4 697 B13R2.45 CSc1sc2ccccc2c1Br 62a_100015504031_200000210301 [0,2,0,0,0,0|1,0,1]=4 698 B13R2.45 CSc1sc2ccccc2c1Br 62a_200000210301_100015504031 [0,2,0,0,0,0|1,0,1]=4 699 B13R2.45 CSc1sc2ccccc2c1C 62a_200000210301_200010198769 [0,2,0,0,0,0|1,0,1]=4 700 B13R2.45 Cc1c(sc2c1cccc2)S[13CH3] 62a_200025704644_200010198769 [0,2,0,0,0,0|1,0,1]=4 701 B13R2.45 Cn1c(cc2c1cccc2)O[13CH3] 34a_100000066695_200025704644 [0,2,0,0,0,0|1,1,0]=4 702 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200000239431_200025704644 [0,2,0,0,0,0|1,0,1]=4 703 B13R2.45 Cn1c(nc2c1cccc2)S[13CH3] 62a_200025704644_200000239431 [0,2,0,0,0,0|1,0,1]=4 704 B13R2.45 O=Cc1sc2ccccc2c1O 271570a_203496583355_100009816528 [0,2,0,0,0,0|1,1,0]=4 705 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_100015504031_200025704644 [0,2,0,0,0,0|1,0,1]=4 706 B13R2.45 [13CH3]Sc1sc2ccccc2c1Br 62a_200025704644_100015504031 [0,2,0,0,0,0|1,0,1]=4 707 B13R2.135 C=Cc1c(sc2c1cccc2)C 271570a_100011290941_100010002616 [0,2,0,0,0,0|2,0,0]=4 708 B13R2.135 CSC1C(=O)Nc2c1cccc2 62a_200000210301_200009996675 [0,2,0,0,0,0|1,1,0]=4 709 B13R2.135 CSc1c(sc2c1cccc2)C 62a_100010002616_200000210301 [0,2,0,0,0,0|2,0,0]=4 710 B13R2.135 CSc1c(sc2c1cccc2)C 62a_200000210301_100010002616 [0,2,0,0,0,0|2,0,0]=4 711 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_100010002616_200025704644 [0,2,0,0,0,0|2,0,0]=4 712 B13R2.135 Cc1sc2ccccc2c1S[13CH3] 62a_200025704644_100010002616 [0,2,0,0,0,0|2,0,0]=4 713 B13R2.135 [13CH3]SC1C(=O)Nc2c1cccc2 62a_200025704644_200009996675 [0,2,0,0,0,0|1,1,0]=4 714 B13R2.3028 CC1C(=O)Nc2c1cc(cc2)O 271570a_203496583355_100010251565 [0,2,0,0,0,0|1,1,0]=4 715 B13R2.3028 CN1C(=O)Cc2c1cc(cc2)O 271570a_203496583355_100010285470 [0,2,0,0,0,0|1,1,0]=4 716 B13R2.3028 Cc1[nH]c2ccc(cc2c1C)O 271570a_203496583355_100012262263 [0,2,0,0,0,0|2,0,0]=4 717 B13R2.3028 Cc1nc2ccc(cc2n1C)O 271570a_203496583355_200010218347 [0,2,0,0,0,0|2,0,0]=4 718 B13R2.3028 Cn1c(=O)[nH]c2c1cc(cc2)O 271570a_203496583355_100010393459 [0,2,0,0,0,0|1,1,0]=4 719 B13R2.3028 Nc1sc2ccc(cc2[n+]1[O-])O 271570a_203496583355_200010069761 [0,2,0,0,0,0|1,0,1]=4 720 B13R2.3028 O=C1Nc2ccc(cc2C1=O)O 271570a_203496583355_100000024671 [0,2,0,0,0,0|1,1,0]=4 721 B13R2.4825 O=C1Nc2c(cccc2C1=O)O 271570a_203496583355_100000183292 [0,2,0,0,0,0|1,1,0]=4 722 B13R2.4856 CN1C(=O)Cc2c1c(ccc2)O 271570a_203496583355_100010870571 [0,2,0,0,0,0|1,1,0]=4 723 B13R2.4856 Cn1c(=O)[nH]c2c1c(ccc2)O 271570a_203496583355_100010994120 [0,2,0,0,0,0|1,1,0]=4 724 B13R2.4856 O=C1Nc2cccc(c2C1=O)O 271570a_203496583355_100000697038 [0,2,0,0,0,0|1,1,0]=4 725 B13R2.5190 CC1C(=O)Nc2c1ccc(c2)O 271570a_203496583355_100010201481 [0,2,0,0,0,0|1,1,0]=4 726 B13R2.5190 CN1C(=O)Cc2c1ccc(c2)O 271570a_203496583355_100000183948 [0,2,0,0,0,0|1,1,0]=4 727 B13R2.5190 Cc1nc2cc(ccc2n1C)O 271570a_203496583355_100000729442 [0,2,0,0,0,0|2,0,0]=4 728 B13R2.5190 Cn1c(=O)oc2c1ccc(c2)O 271570a_203496583355_100000753874 [0,2,0,0,0,0|0,2,0]=4 729 B13R2.5190 Cn1c(nc2c1ccc(c2)O)O 271570a_203496583355_100013992850 [0,2,0,0,0,0|1,1,0]=4 730 B13R2.5190 O=C1Nc2cc(ccc2C1=O)O 271570a_203496583355_100000239657 [0,2,0,0,0,0|1,1,0]=4 731 B13R2.26 C=C=Cc1cc2ccccc2[nH]1 271570a_100015277604_100010232065 [0,2,0,0,0,0|2,0,0]=4 732 B13R2.26 C=C=Cc1cc2ccccc2s1 271570a_100015277604_100009816949 [0,2,0,0,0,0|2,0,0]=4 733 B13R2.26 C=C=Cc1nc2ccccc2[nH]1 271570a_100015277604_100009814255 [0,2,0,0,0,0|2,0,0]=4 734 B13R2.26 C=C=Cc1nc2ccccc2s1 271570a_100015277604_100000751744 [0,2,0,0,0,0|1,0,1]=4 735 B13R2.26 CC=Cc1cc2ccccc2[nH]1 271570a_100016259895_100010232065 [0,2,0,0,0,0|2,0,0]=4 736 B13R2.26 CC=Cc1cc2ccccc2s1 271570a_100016259895_100009816949 [0,2,0,0,0,0|2,0,0]=4 737 B13R2.26 CC=Cc1nc2ccccc2[nH]1 271570a_100016259895_100009814255 [0,2,0,0,0,0|2,0,0]=4 738 B13R2.26 CC=Cc1nc2ccccc2s1 271570a_100016259895_100000751744 [0,2,0,0,0,0|1,0,1]=4 739 B13R2.26 CCNc1nc2ccccc2[nH]1 27a_100015525214_100009814255 [0,2,0,0,0,0|2,0,0]=4 740 B13R2.26 CCNc1nc2ccccc2s1 27a_100015525214_100000751744 [0,2,0,0,0,0|1,0,1]=4 741 B13R2.26 CCSc1cc2ccccc2[nH]1 62a_100000210202_100010232065 [0,2,0,0,0,0|1,0,1]=4 742 B13R2.26 CCSc1cc2ccccc2s1 62a_100000210202_100009816949 [0,2,0,0,0,0|1,0,1]=4 743 B13R2.26 CCSc1nc2ccccc2[nH]1 62a_100000210202_100009814255 [0,2,0,0,0,0|1,0,1]=4 744 B13R2.26 CCSc1nc2ccccc2s1 62a_100000210202_100000751744 [0,2,0,0,0,0|0,0,2]=4 745 B13R2.26 CNCc1cc2ccccc2[nH]1 270004a_106832991635_100000051030 [0,2,0,0,0,0|2,0,0]=4 746 B13R2.26 CNCc1cc2ccccc2s1 207a_100102657272_100000686906 [0,2,0,0,0,0|2,0,0]=4 747 B13R2.26 CNCc1cc2ccccc2s1 2230a_100015187092_200000210301 [0,2,0,0,0,0|2,0,0]=4 748 B13R2.26 CNCc1cc2ccccc2s1 270004a_106832991635_100000686906 [0,2,0,0,0,0|2,0,0]=4 749 B13R2.26 CNCc1nc2ccccc2[nH]1 207a_100102657272_100000185668 [0,2,0,0,0,0|2,0,0]=4 750 B13R2.26 CNCc1nc2ccccc2[nH]1 2230a_106832991635_100000737899 [0,2,0,0,0,0|2,0,0]=4 751 B13R2.26 CNCc1nc2ccccc2[nH]1 270004a_106832991635_100000185668 [0,2,0,0,0,0|2,0,0]=4 752 B13R2.26 CNCc1nc2ccccc2[nH]1 7a_106832991635_100000737899 [0,2,0,0,0,0|2,0,0]=4 753 B13R2.26 CNCc1nc2ccccc2s1 2230a_106832991635_100000766747 [0,2,0,0,0,0|1,0,1]=4 754 B13R2.26 CNCc1nc2ccccc2s1 270004a_106832991635_100011204187 [0,2,0,0,0,0|1,0,1]=4 755 B13R2.26 CNCc1nc2ccccc2s1 34a_100102657272_100011217541 [0,2,0,0,0,0|1,0,1]=4 756 B13R2.26 CNCc1nc2ccccc2s1 7a_106832991635_100011217541 [0,2,0,0,0,0|1,0,1]=4 757 B13R2.26 COCc1nc2ccccc2s1 34a_100138415774_100011217541 [0,2,0,0,0,0|0,1,1]=4 758 B13R2.26 CSCc1nc2ccccc2[nH]1 62a_200000210301_100000737899 [0,2,0,0,0,0|1,0,1]=4 759 B13R2.26 CSCc1nc2ccccc2s1 62a_100011217541_200000210301 [0,2,0,0,0,0|0,0,2]=4 760 B13R2.26 CSCc1nc2ccccc2s1 62a_200000210301_100000766747 [0,2,0,0,0,0|0,0,2]=4 761 B13R2.26 FCSc1cc2ccccc2[nH]1 62a_100015361967_100010232065 [0,2,0,0,0,0|1,0,1]=4 762 B13R2.26 FCSc1cc2ccccc2s1 62a_100015361967_100009816949 [0,2,0,0,0,0|1,0,1]=4 763 B13R2.26 FCSc1nc2ccccc2[nH]1 62a_100015361967_100009814255 [0,2,0,0,0,0|1,0,1]=4 764 B13R2.26 FCSc1nc2ccccc2s1 62a_100015361967_100000751744 [0,2,0,0,0,0|0,0,2]=4 765 B13R2.26 [13CH3]NCc1cc2ccccc2s1 2230a_100015187092_200025704644 [0,2,0,0,0,0|2,0,0]=4 766 B13R2.26 [13CH3]SCc1nc2ccccc2[nH]1 62a_200025704644_100000737899 [0,2,0,0,0,0|1,0,1]=4 767 B13R2.26 [13CH3]SCc1nc2ccccc2s1 62a_100011217541_200025704644 [0,2,0,0,0,0|0,0,2]=4 768 B13R2.26 [13CH3]SCc1nc2ccccc2s1 62a_200025704644_100000766747 [0,2,0,0,0,0|0,0,2]=4 769 B13R2.43 C=Cc1cc2cc(ccc2[nH]1)Br 271570a_100011290941_100011012855 [0,2,0,0,0,0|2,0,0]=4 770 B13R2.43 C=Cc1cc2cc(ccc2s1)Br 271570a_100011290941_200010198765 [0,2,0,0,0,0|2,0,0]=4 771 B13R2.43 C=Cc1nc2cc(ccc2s1)F 271570a_100011290941_200010206605 [0,2,0,0,0,0|1,0,1]=4 772 B13R2.43 C=Cc1nc2cc(ccc2s1)N 271570a_100011290941_100010329861 [0,2,0,0,0,0|1,0,1]=4 773 B13R2.43 C=Cc1nc2ccc(cc2s1)C 271570a_100011290941_100010186437 [0,2,0,0,0,0|1,0,1]=4 774 B13R2.43 C=Cc1nc2ccc(cc2s1)F 271570a_100011290941_100000751617 [0,2,0,0,0,0|1,0,1]=4 775 B13R2.43 C=Cc1nc2ccc(cc2s1)N 271570a_100011290941_100010253933 [0,2,0,0,0,0|1,0,1]=4 776 B13R2.43 C=Cc1nc2ccc(cc2s1)O 271570a_100011290941_100010063415 [0,2,0,0,0,0|1,0,1]=4 777 B13R2.43 CNc1nc2cc(ccc2s1)F 27a_100102657272_200010206605 [0,2,0,0,0,0|1,0,1]=4 778 B13R2.43 CNc1nc2cc(ccc2s1)N 27a_100102657272_100010329861 [0,2,0,0,0,0|1,0,1]=4 779 B13R2.43 CNc1nc2ccc(cc2s1)C 27a_100102657272_100010186437 [0,2,0,0,0,0|1,0,1]=4 780 B13R2.43 CNc1nc2ccc(cc2s1)F 27a_100102657272_100000751617 [0,2,0,0,0,0|1,0,1]=4 781 B13R2.43 CNc1nc2ccc(cc2s1)N 27a_100102657272_100010253933 [0,2,0,0,0,0|1,0,1]=4 782 B13R2.43 CNc1nc2ccc(cc2s1)O 271570a_203496583355_100012351673 [0,2,0,0,0,0|1,0,1]=4 783 B13R2.43 CNc1nc2ccc(cc2s1)O 27a_100102657272_100010063415 [0,2,0,0,0,0|1,0,1]=4 784 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200000210301 [0,2,0,0,0,0|1,0,1]=4 785 B13R2.43 CSc1cc2cc(ccc2[nH]1)Br 62a_200000210301_100011012855 [0,2,0,0,0,0|1,0,1]=4 786 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200000210301_200010198765 [0,2,0,0,0,0|1,0,1]=4 787 B13R2.43 CSc1cc2cc(ccc2s1)Br 62a_200010198765_200000210301 [0,2,0,0,0,0|1,0,1]=4 788 B13R2.43 CSc1nc2cc(ccc2s1)F 62a_200000210301_200010206605 [0,2,0,0,0,0|0,0,2]=4 789 B13R2.43 CSc1nc2cc(ccc2s1)F 62a_200010206605_200000210301 [0,2,0,0,0,0|0,0,2]=4 790 B13R2.43 CSc1nc2cc(ccc2s1)N 62a_100010329861_200000210301 [0,2,0,0,0,0|0,0,2]=4 791 B13R2.43 CSc1nc2cc(ccc2s1)N 62a_200000210301_100010329861 [0,2,0,0,0,0|0,0,2]=4 792 B13R2.43 CSc1nc2cc(ccc2s1)O 271570a_203496583355_200010003198 [0,2,0,0,0,0|0,0,2]=4 793 B13R2.43 CSc1nc2ccc(cc2s1)C 62a_200000210301_100010186437 [0,2,0,0,0,0|0,0,2]=4 794 B13R2.43 CSc1nc2ccc(cc2s1)F 62a_100000751617_200000210301 [0,2,0,0,0,0|0,0,2]=4 795 B13R2.43 CSc1nc2ccc(cc2s1)F 62a_200000210301_100000751617 [0,2,0,0,0,0|0,0,2]=4 796 B13R2.43 CSc1nc2ccc(cc2s1)N 62a_100010253933_200000210301 [0,2,0,0,0,0|0,0,2]=4 797 B13R2.43 CSc1nc2ccc(cc2s1)N 62a_200000210301_100010253933 [0,2,0,0,0,0|0,0,2]=4 798 B13R2.43 CSc1nc2ccc(cc2s1)O 271570a_203496583355_100010193624 [0,2,0,0,0,0|0,0,2]=4 799 B13R2.43 CSc1nc2ccc(cc2s1)O 62a_200000210301_100010063415 [0,2,0,0,0,0|0,0,2]=4 800 B13R2.43 Cc1ccc2nc(sc2c1)S[13CH3] 62a_200025704644_100010186437 [0,2,0,0,0,0|0,0,2]=4 801 B13R2.43 N#Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100010261159 [0,2,0,0,0,0|2,0,0]=4 802 B13R2.43 N#Cc1cc2cc(ccc2s1)O 271570a_203496583355_200010238524 [0,2,0,0,0,0|2,0,0]=4 803 B13R2.43 N#Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100010739539 [0,2,0,0,0,0|2,0,0]=4 804 B13R2.43 NNc1nc2ccc(cc2s1)O 271570a_203496583355_100009816745 [0,2,0,0,0,0|1,0,1]=4 805 B13R2.43 O=Cc1cc2cc(ccc2[nH]1)O 271570a_203496583355_100009820874 [0,2,0,0,0,0|1,1,0]=4 806 B13R2.43 O=Cc1cc2cc(ccc2s1)O 271570a_203496583355_100010238522 [0,2,0,0,0,0|1,1,0]=4 807 B13R2.43 O=Cc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000736022 [0,2,0,0,0,0|1,1,0]=4 808 B13R2.43 O=Cc1cc2ccc(cc2s1)O 271570a_203496583355_100009814784 [0,2,0,0,0,0|1,1,0]=4 809 B13R2.43 O=Cc1nc2ccc(cc2[nH]1)O 271570a_203496583355_200011361486 [0,2,0,0,0,0|1,1,0]=4 810 B13R2.43 OCc1cc2cc(ccc2s1)O 271570a_203496583355_100010255381 [0,2,0,0,0,0|1,1,0]=4 811 B13R2.43 OCc1cc2ccc(cc2[nH]1)O 271570a_203496583355_100000735881 [0,2,0,0,0,0|1,1,0]=4 812 B13R2.43 OCc1cc2ccc(cc2s1)O 271570a_203496583355_100010244134 [0,2,0,0,0,0|1,1,0]=4 813 B13R2.43 OCc1nc2cc(ccc2[nH]1)O 271570a_203496583355_100000698547 [0,2,0,0,0,0|1,1,0]=4 814 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_100011012855_200025704644 [0,2,0,0,0,0|1,0,1]=4 815 B13R2.43 [13CH3]Sc1cc2cc(ccc2[nH]1)Br 62a_200025704644_100011012855 [0,2,0,0,0,0|1,0,1]=4 816 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200010198765_200025704644 [0,2,0,0,0,0|1,0,1]=4 817 B13R2.43 [13CH3]Sc1cc2cc(ccc2s1)Br 62a_200025704644_200010198765 [0,2,0,0,0,0|1,0,1]=4 818 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)F 62a_200010206605_200025704644 [0,2,0,0,0,0|0,0,2]=4 819 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)F 62a_200025704644_200010206605 [0,2,0,0,0,0|0,0,2]=4 820 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)N 62a_100010329861_200025704644 [0,2,0,0,0,0|0,0,2]=4 821 B13R2.43 [13CH3]Sc1nc2cc(ccc2s1)N 62a_200025704644_100010329861 [0,2,0,0,0,0|0,0,2]=4 822 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)F 62a_100000751617_200025704644 [0,2,0,0,0,0|0,0,2]=4 823 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)F 62a_200025704644_100000751617 [0,2,0,0,0,0|0,0,2]=4 824 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)N 62a_100010253933_200025704644 [0,2,0,0,0,0|0,0,2]=4 825 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)N 62a_200025704644_100010253933 [0,2,0,0,0,0|0,0,2]=4 826 B13R2.43 [13CH3]Sc1nc2ccc(cc2s1)O 62a_200025704644_100010063415 [0,2,0,0,0,0|0,0,2]=4 827 B13R2.54 C=Cc1cc2cccc(c2[nH]1)Br 271570a_100011290941_100135389745 [0,2,0,0,0,0|2,0,0]=4 828 B13R2.54 C=Cc1nc2c(cccc2s1)C 271570a_100011290941_100010008827 [0,2,0,0,0,0|1,0,1]=4 829 B13R2.54 C=Cc1nc2c(cccc2s1)F 271570a_100011290941_100010008856 [0,2,0,0,0,0|1,0,1]=4 830 B13R2.54 CNc1nc2c(cccc2s1)C 27a_100102657272_100010008827 [0,2,0,0,0,0|1,0,1]=4 831 B13R2.54 CNc1nc2c(cccc2s1)F 27a_100102657272_100010008856 [0,2,0,0,0,0|1,0,1]=4 832 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_100135389745_200000210301 [0,2,0,0,0,0|1,0,1]=4 833 B13R2.54 CSc1cc2cccc(c2[nH]1)Br 62a_200000210301_100135389745 [0,2,0,0,0,0|1,0,1]=4 834 B13R2.54 CSc1nc2c(cccc2s1)C 62a_200000210301_100010008827 [0,2,0,0,0,0|0,0,2]=4 835 B13R2.54 CSc1nc2c(cccc2s1)F 62a_200000210301_100010008856 [0,2,0,0,0,0|0,0,2]=4 836 B13R2.54 Cc1cccc2c1nc(s2)S[13CH3] 62a_200025704644_100010008827 [0,2,0,0,0,0|0,0,2]=4 837 B13R2.54 N#Cc1cc2c(cccc2[nH]1)O 271570a_203496583355_100010174851 [0,2,0,0,0,0|2,0,0]=4 838 B13R2.54 NNc1nc2c(cccc2s1)O 271570a_203496583355_100009820880 [0,2,0,0,0,0|1,0,1]=4 839 B13R2.54 O=Cc1cc2c(cccc2s1)O 271570a_203496583355_100010109917 [0,2,0,0,0,0|1,1,0]=4 840 B13R2.54 O=Cc1cc2cccc(c2s1)O 271570a_203496583355_100010110135 [0,2,0,0,0,0|1,1,0]=4 841 B13R2.54 OCc1cc2cccc(c2s1)O 271570a_203496583355_100010255382 [0,2,0,0,0,0|1,1,0]=4 842 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_100135389745_200025704644 [0,2,0,0,0,0|1,0,1]=4 843 B13R2.54 [13CH3]Sc1cc2cccc(c2[nH]1)Br 62a_200025704644_100135389745 [0,2,0,0,0,0|1,0,1]=4 844 B13R2.54 [13CH3]Sc1nc2c(cccc2s1)F 62a_200025704644_100010008856 [0,2,0,0,0,0|0,0,2]=4 845 B13R2.435 C=C(C)c1cc2ccccc2[nH]1 271570a_100000694244_100010232065 [0,2,0,0,0,0|2,0,0]=4 846 B13R2.435 C=C(C)c1cc2ccccc2s1 271570a_100000694244_100009816949 [0,2,0,0,0,0|2,0,0]=4 847 B13R2.435 C=C(C)c1nc2ccccc2[nH]1 271570a_100000694244_100009814255 [0,2,0,0,0,0|2,0,0]=4 848 B13R2.435 C=C(C)c1nc2ccccc2s1 271570a_100000694244_100000751744 [0,2,0,0,0,0|1,0,1]=4 849 B13R2.435 CN(C)c1nc2ccccc2[nH]1 27a_100102631434_100009814255 [0,2,0,0,0,0|2,0,0]=4 850 B13R2.435 CN(C)c1nc2ccccc2s1 27a_100102631434_100000751744 [0,2,0,0,0,0|1,0,1]=4 851 B13R2.581 C=Cc1cccc2c1CC(=O)N2 271570a_100011290941_100009816812 [0,2,0,0,0,0|1,1,0]=4 852 B13R2.581 C=Cc1cccc2c1NC(=O)C2 271570a_100011290941_100000767046 [0,2,0,0,0,0|1,1,0]=4 853 B13R2.581 C=Cc1cccc2c1cc([nH]2)C 271570a_100011290941_100010143266 [0,2,0,0,0,0|2,0,0]=4 854 B13R2.581 C=Cc1cccc2c1nc([nH]2)C 271570a_100011290941_100012360556 [0,2,0,0,0,0|2,0,0]=4 855 B13R2.581 C=Cc1cccc2c1nc([nH]2)N 271570a_100011290941_100012356985 [0,2,0,0,0,0|2,0,0]=4 856 B13R2.581 C=Cc1cccc2c1nc([nH]2)O 271570a_100011290941_100012347640 [0,2,0,0,0,0|1,1,0]=4 857 B13R2.581 C=Cc1cccc2c1nc(s2)C 271570a_100011290941_100010236672 [0,2,0,0,0,0|1,0,1]=4 858 B13R2.581 C=Cc1cccc2c1nc(s2)N 271570a_100011290941_100000724365 [0,2,0,0,0,0|1,0,1]=4 859 B13R2.581 C=Cc1cccc2c1oc(=O)[nH]2 271570a_100011290941_100012360093 [0,2,0,0,0,0|0,2,0]=4 860 B13R2.581 C=Cc1cccc2c1sc(c2)N 271570a_100011290941_100010090802 [0,2,0,0,0,0|2,0,0]=4 861 B13R2.581 C=Cc1cccc2c1sc(n2)C 271570a_100011290941_100010236699 [0,2,0,0,0,0|1,0,1]=4 862 B13R2.581 C=Cc1cccc2c1sc(n2)N 271570a_100011290941_100010235960 [0,2,0,0,0,0|1,0,1]=4 863 B13R2.581 COc1cccc2c1cc([nH]2)C 34a_200000059750_200000210301 [0,2,0,0,0,0|2,0,0]=4 864 B13R2.581 COc1cccc2c1nc(s2)N 7a_100000065795_200000210301 [0,2,0,0,0,0|1,0,1]=4 865 B13R2.581 COc1cccc2c1nc(s2)O 271570a_203496583355_100010195968 [0,2,0,0,0,0|0,1,1]=4 866 B13R2.581 CSc1cccc2c1CC(=O)N2 62a_200000210301_100009816812 [0,2,0,0,0,0|1,1,0]=4 867 B13R2.581 CSc1cccc2c1NC(=O)C2 62a_200000210301_100000767046 [0,2,0,0,0,0|1,1,0]=4 868 B13R2.581 CSc1cccc2c1cc([nH]2)C 62a_200000210301_100010143266 [0,2,0,0,0,0|2,0,0]=4 869 B13R2.581 CSc1cccc2c1nc([nH]2)C 62a_200000210301_100012360556 [0,2,0,0,0,0|2,0,0]=4 870 B13R2.581 CSc1cccc2c1nc(s2)C 62a_100010236672_200000210301 [0,2,0,0,0,0|1,0,1]=4 871 B13R2.581 CSc1cccc2c1nc(s2)C 62a_200000210301_100010236672 [0,2,0,0,0,0|1,0,1]=4 872 B13R2.581 CSc1cccc2c1nc(s2)N 62a_100000724365_200000210301 [0,2,0,0,0,0|1,0,1]=4 873 B13R2.581 CSc1cccc2c1sc(c2)N 62a_100010090802_200000210301 [0,2,0,0,0,0|2,0,0]=4 874 B13R2.581 CSc1cccc2c1sc(n2)C 62a_100010236699_200000210301 [0,2,0,0,0,0|1,0,1]=4 875 B13R2.581 CSc1cccc2c1sc(n2)C 62a_200000210301_100010236699 [0,2,0,0,0,0|1,0,1]=4 876 B13R2.581 CSc1cccc2c1sc(n2)N 62a_100010235960_200000210301 [0,2,0,0,0,0|1,0,1]=4 877 B13R2.581 Cc1cc2c(cccc2[nH]1)O[13CH3] 34a_200000059750_200025704644 [0,2,0,0,0,0|2,0,0]=4 878 B13R2.581 Cc1cc2c(cccc2[nH]1)S[13CH3] 62a_200025704644_100010143266 [0,2,0,0,0,0|2,0,0]=4 879 B13R2.581 Cc1nc2c(cccc2[nH]1)S[13CH3] 62a_200025704644_100012360556 [0,2,0,0,0,0|2,0,0]=4 880 B13R2.581 Cc1nc2c(cccc2s1)S[13CH3] 62a_100010236672_200025704644 [0,2,0,0,0,0|1,0,1]=4 881 B13R2.581 Cc1nc2c(cccc2s1)S[13CH3] 62a_200025704644_100010236672 [0,2,0,0,0,0|1,0,1]=4 882 B13R2.581 Cc1nc2cccc(c2s1)S[13CH3] 62a_100010236699_200025704644 [0,2,0,0,0,0|1,0,1]=4 883 B13R2.581 Cc1nc2cccc(c2s1)S[13CH3] 62a_200025704644_100010236699 [0,2,0,0,0,0|1,0,1]=4 884 B13R2.581 [13CH3]Oc1cccc2c1nc(s2)N 7a_100000065795_200025704644 [0,2,0,0,0,0|1,0,1]=4 885 B13R2.581 [13CH3]Sc1cccc2c1CC(=O)N2 62a_200025704644_100009816812 [0,2,0,0,0,0|1,1,0]=4 886 B13R2.581 [13CH3]Sc1cccc2c1NC(=O)C2 62a_200025704644_100000767046 [0,2,0,0,0,0|1,1,0]=4 887 B13R2.581 [13CH3]Sc1cccc2c1nc(s2)N 62a_100000724365_200025704644 [0,2,0,0,0,0|1,0,1]=4 888 B13R2.581 [13CH3]Sc1cccc2c1sc(c2)N 62a_100010090802_200025704644 [0,2,0,0,0,0|2,0,0]=4 889 B13R2.581 [13CH3]Sc1cccc2c1sc(n2)N 62a_100010235960_200025704644 [0,2,0,0,0,0|1,0,1]=4 890 B13R2.3050 Cc1c(ccc2c1nc(s2)N)O 271570a_203496583355_200013315943 [0,2,0,0,0,0|1,0,1]=4 891 B13R2.3050 Cc1ccc2c(c1O)CC(=O)N2 271570a_203496583355_100015548004 [0,2,0,0,0,0|1,1,0]=4 892 B13R2.3050 Cc1ccc2sc(nc2c1O)N 271570a_203496583355_100012962237 [0,2,0,0,0,0|1,0,1]=4 893 B13R2.3050 Nc1nc2c(c(ccc2s1)O)F 271570a_203496583355_200010762653 [0,2,0,0,0,0|1,0,1]=4 894 B13R2.5139 Nc1nc2c(ccc(c2s1)F)O 271570a_203496583355_100012355747 [0,2,0,0,0,0|1,0,1]=4 895 B13R2.5139 O=C1Cc2c(ccc(c2N1)F)O 271570a_203496583355_100012355367 [0,2,0,0,0,0|1,1,0]=4 896 B13R2.5397 Cc1cc(c2nc(sc2c1)N)O 271570a_203496583355_200011246637 [0,2,0,0,0,0|1,0,1]=4 897 B13R2.5397 Cc1nc2c(cc(cc2s1)O)F 271570a_203496583355_100000719245 [0,2,0,0,0,0|1,0,1]=4 898 B13R2.5397 Nc1nc2c(cc(cc2s1)F)O 271570a_203496583355_100012022072 [0,2,0,0,0,0|1,0,1]=4 899 B13R2.5397 Nc1nc2c(cc(cc2s1)O)F 271570a_203496583355_100011246640 [0,2,0,0,0,0|1,0,1]=4 900 B13R2.5397 Nc1nc2cc(cc(c2[nH]1)O)O 271570a_203496583355_100015644475 [0,2,0,0,0,0|2,0,0]=4 901 B13R2.2121 C=Cc1ccc2[nH]c(=O)[nH]c2c1 271570a_100011290941_100011221360 [0,2,0,0,0,0|1,1,0]=4 902 B13R2.2121 C=Cc1ccc2[nH]c(=O)oc2c1 271570a_100011290941_100000697996 [0,2,0,0,0,0|0,2,0]=4 903 B13R2.2121 C=Cc1ccc2[nH]c(=O)sc2c1 271570a_100011290941_100009813980 [0,2,0,0,0,0|0,1,0]=3 904 B13R2.2121 C=Cc1ccc2[nH]c(cc2c1)C 271570a_100011290941_100011214893 [0,2,0,0,0,0|2,0,0]=4 905 B13R2.2121 C=Cc1ccc2[nH]c(nc2c1)C 271570a_100011290941_100011264012 [0,2,0,0,0,0|2,0,0]=4 906 B13R2.2121 C=Cc1ccc2[nH]c(nc2c1)N 271570a_100011290941_100000764686 [0,2,0,0,0,0|2,0,0]=4 907 B13R2.2121 C=Cc1ccc2c(c1)CC(=O)N2 271570a_100011290941_100000754858 [0,2,0,0,0,0|1,1,0]=4 908 B13R2.2121 C=Cc1ccc2c(c1)NC(=O)C2 271570a_100011290941_100000760487 [0,2,0,0,0,0|1,1,0]=4 909 B13R2.2121 C=Cc1ccc2cc([nH]c2c1)C 271570a_100011290941_100010196937 [0,2,0,0,0,0|2,0,0]=4 910 B13R2.2121 C=Cc1ccc2nc(sc2c1)C 271570a_100011290941_100009813144 [0,2,0,0,0,0|1,0,1]=4 911 B13R2.2121 C=Cc1ccc2nc(sc2c1)Cl 271570a_100011290941_100010163703 [0,2,0,0,0,0|1,0,1]=4 912 B13R2.2121 C=Cc1ccc2nc(sc2c1)N 271570a_100011290941_100102524914 [0,2,0,0,0,0|1,0,1]=4 913 B13R2.2121 C=Cc1ccc2oc(=O)[nH]c2c1 271570a_100011290941_100000764829 [0,2,0,0,0,0|0,2,0]=4 914 B13R2.2121 C=Cc1ccc2sc(=O)[nH]c2c1 271570a_100011290941_100000239354 [0,2,0,0,0,0|0,1,0]=3 915 B13R2.2121 C=Cc1ccc2sc(cc2c1)C 271570a_100011290941_100000695401 [0,2,0,0,0,0|2,0,0]=4 916 B13R2.2121 C=Cc1ccc2sc(nc2c1)C 271570a_100011290941_100009813953 [0,2,0,0,0,0|1,0,1]=4 917 B13R2.2121 C=Cc1ccc2sc(nc2c1)N 271570a_100011290941_100011934045 [0,2,0,0,0,0|1,0,1]=4 918 B13R2.2121 CNc1ccc2nc(sc2c1)Cl 27a_100102657272_100010163703 [0,2,0,0,0,0|1,0,1]=4 919 B13R2.2121 COc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200000210301 [0,2,0,0,0,0|0,2,0]=4 920 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 34a_100000073708_200000210301 [0,2,0,0,0,0|2,0,0]=4 921 B13R2.2121 COc1ccc2[nH]c(cc2c1)C 7a_100000073708_200000210301 [0,2,0,0,0,0|2,0,0]=4 922 B13R2.2121 COc1ccc2cc([nH]c2c1)C 34a_100000058111_200000210301 [0,2,0,0,0,0|2,0,0]=4 923 B13R2.2121 COc1ccc2nc(sc2c1)Br 7a_100010063415_200000210301 [0,2,0,0,0,0|1,0,1]=4 924 B13R2.2121 COc1ccc2nc(sc2c1)C 34a_100000008955_200000210301 [0,2,0,0,0,0|1,0,1]=4 925 B13R2.2121 COc1ccc2nc(sc2c1)C 7a_100000008955_200000210301 [0,2,0,0,0,0|1,0,1]=4 926 B13R2.2121 COc1ccc2nc(sc2c1)N 7a_100000012012_200000210301 [0,2,0,0,0,0|1,0,1]=4 927 B13R2.2121 COc1ccc2nc(sc2c1)O 271570a_203496583355_100010195960 [0,2,0,0,0,0|0,1,1]=4 928 B13R2.2121 COc1ccc2sc(nc2c1)C 34a_100000031546_200000210301 [0,2,0,0,0,0|1,0,1]=4 929 B13R2.2121 COc1ccc2sc(nc2c1)C 7a_100000031546_200000210301 [0,2,0,0,0,0|1,0,1]=4 930 B13R2.2121 COc1ccc2sc(nc2c1)N 7a_100000066538_200000210301 [0,2,0,0,0,0|1,0,1]=4 931 B13R2.2121 CSc1ccc2[nH]c(=O)[nH]c2c1 62a_200000210301_200011356815 [0,2,0,0,0,0|1,1,0]=4 932 B13R2.2121 CSc1ccc2[nH]c(=O)oc2c1 62a_200000210301_100000697996 [0,2,0,0,0,0|0,2,0]=4 933 B13R2.2121 CSc1ccc2[nH]c(cc2c1)C 62a_200000210301_100011214893 [0,2,0,0,0,0|2,0,0]=4 934 B13R2.2121 CSc1ccc2[nH]c(nc2c1)C 62a_200000210301_100011264012 [0,2,0,0,0,0|2,0,0]=4 935 B13R2.2121 CSc1ccc2c(c1)CC(=O)N2 62a_200000210301_100000754858 [0,2,0,0,0,0|1,1,0]=4 936 B13R2.2121 CSc1ccc2c(c1)NC(=O)C2 62a_200000210301_100000760487 [0,2,0,0,0,0|1,1,0]=4 937 B13R2.2121 CSc1ccc2cc([nH]c2c1)C 62a_200000210301_100010196937 [0,2,0,0,0,0|2,0,0]=4 938 B13R2.2121 CSc1ccc2nc([nH]c2c1)Cl 62a_200000210301_100010204286 [0,2,0,0,0,0|2,0,0]=4 939 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_100009813144_200000210301 [0,2,0,0,0,0|1,0,1]=4 940 B13R2.2121 CSc1ccc2nc(sc2c1)C 62a_200000210301_100009813144 [0,2,0,0,0,0|1,0,1]=4 941 B13R2.2121 CSc1ccc2nc(sc2c1)Cl 62a_200000210301_100010163703 [0,2,0,0,0,0|1,0,1]=4 942 B13R2.2121 CSc1ccc2nc(sc2c1)N 62a_100102524914_200000210301 [0,2,0,0,0,0|1,0,1]=4 943 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_100000695401_200000210301 [0,2,0,0,0,0|2,0,0]=4 944 B13R2.2121 CSc1ccc2sc(cc2c1)C 62a_200000210301_100000695401 [0,2,0,0,0,0|2,0,0]=4 945 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_100009813953_200000210301 [0,2,0,0,0,0|1,0,1]=4 946 B13R2.2121 CSc1ccc2sc(nc2c1)C 62a_200000210301_100009813953 [0,2,0,0,0,0|1,0,1]=4 947 B13R2.2121 CSc1ccc2sc(nc2c1)N 62a_100011934045_200000210301 [0,2,0,0,0,0|1,0,1]=4 948 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 34a_100000073708_200025704644 [0,2,0,0,0,0|2,0,0]=4 949 B13R2.2121 Cc1cc2cc(ccc2[nH]1)O[13CH3] 7a_100000073708_200025704644 [0,2,0,0,0,0|2,0,0]=4 950 B13R2.2121 Cc1cc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011214893 [0,2,0,0,0,0|2,0,0]=4 951 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_100000695401_200025704644 [0,2,0,0,0,0|2,0,0]=4 952 B13R2.2121 Cc1cc2cc(ccc2s1)S[13CH3] 62a_200025704644_100000695401 [0,2,0,0,0,0|2,0,0]=4 953 B13R2.2121 Cc1cc2ccc(cc2[nH]1)O[13CH3] 34a_100000058111_200025704644 [0,2,0,0,0,0|2,0,0]=4 954 B13R2.2121 Cc1cc2ccc(cc2[nH]1)S[13CH3] 62a_200025704644_100010196937 [0,2,0,0,0,0|2,0,0]=4 955 B13R2.2121 Cc1nc2cc(ccc2[nH]1)S[13CH3] 62a_200025704644_100011264012 [0,2,0,0,0,0|2,0,0]=4 956 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 34a_100000031546_200025704644 [0,2,0,0,0,0|1,0,1]=4 957 B13R2.2121 Cc1nc2cc(ccc2s1)O[13CH3] 7a_100000031546_200025704644 [0,2,0,0,0,0|1,0,1]=4 958 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_100009813953_200025704644 [0,2,0,0,0,0|1,0,1]=4 959 B13R2.2121 Cc1nc2cc(ccc2s1)S[13CH3] 62a_200025704644_100009813953 [0,2,0,0,0,0|1,0,1]=4 960 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 34a_100000008955_200025704644 [0,2,0,0,0,0|1,0,1]=4 961 B13R2.2121 Cc1nc2ccc(cc2s1)O[13CH3] 7a_100000008955_200025704644 [0,2,0,0,0,0|1,0,1]=4 962 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_100009813144_200025704644 [0,2,0,0,0,0|1,0,1]=4 963 B13R2.2121 Cc1nc2ccc(cc2s1)S[13CH3] 62a_200025704644_100009813144 [0,2,0,0,0,0|1,0,1]=4 964 B13R2.2121 O=Cc1ccc2nc(sc2c1)O 271570a_203496583355_200010272093 [0,2,0,0,0,0|0,1,1]=4 965 B13R2.2121 [13CH3]Oc1ccc2[nH]c(=O)oc2c1 7a_200000068749_200025704644 [0,2,0,0,0,0|0,2,0]=4 966 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)Br 7a_100010063415_200025704644 [0,2,0,0,0,0|1,0,1]=4 967 B13R2.2121 [13CH3]Oc1ccc2nc(sc2c1)N 7a_100000012012_200025704644 [0,2,0,0,0,0|1,0,1]=4 968 B13R2.2121 [13CH3]Oc1ccc2sc(nc2c1)N 7a_100000066538_200025704644 [0,2,0,0,0,0|1,0,1]=4 969 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)[nH]c2c1 62a_200025704644_200011356815 [0,2,0,0,0,0|1,1,0]=4 970 B13R2.2121 [13CH3]Sc1ccc2[nH]c(=O)oc2c1 62a_200025704644_100000697996 [0,2,0,0,0,0|0,2,0]=4 971 B13R2.2121 [13CH3]Sc1ccc2c(c1)CC(=O)N2 62a_200025704644_100000754858 [0,2,0,0,0,0|1,1,0]=4 972 B13R2.2121 [13CH3]Sc1ccc2c(c1)NC(=O)C2 62a_200025704644_100000760487 [0,2,0,0,0,0|1,1,0]=4 973 B13R2.2121 [13CH3]Sc1ccc2nc([nH]c2c1)Cl 62a_200025704644_100010204286 [0,2,0,0,0,0|2,0,0]=4 974 B13R2.2121 [13CH3]Sc1ccc2nc(sc2c1)Cl 62a_200025704644_100010163703 [0,2,0,0,0,0|1,0,1]=4 975 B13R2.2121 [13CH3]Sc1ccc2nc(sc2c1)N 62a_100102524914_200025704644 [0,2,0,0,0,0|1,0,1]=4 976 B13R2.2121 [13CH3]Sc1ccc2sc(nc2c1)N 62a_100011934045_200025704644 [0,2,0,0,0,0|1,0,1]=4 977 B13R2.13083 Cc1cc2[nH]c(=O)[nH]c2cc1O 271570a_203496583355_100010107294 [0,2,0,0,0,0|1,1,0]=4 978 B13R2.13083 Cc1cc2c(cc1O)CC(=O)N2 271570a_203496583355_100010201617 [0,2,0,0,0,0|1,1,0]=4 979 B13R2.13083 Cc1cc2cc(c(cc2[nH]1)F)O 271570a_203496583355_200010763346 [0,2,0,0,0,0|2,0,0]=4 980 B13R2.13083 Cc1nc2cc(c(cc2[nH]1)F)O 271570a_203496583355_100000733457 [0,2,0,0,0,0|2,0,0]=4 981 B13R2.13083 Cc1nc2cc(c(cc2s1)O)C 271570a_203496583355_200010762721 [0,2,0,0,0,0|1,0,1]=4 982 B13R2.13083 Nc1nc2cc(c(cc2s1)F)O 271570a_203496583355_100010744686 [0,2,0,0,0,0|1,0,1]=4 983 B13R2.13083 O=C1Cc2cc(c(cc2N1)Cl)O 271570a_203496583355_100012929135 [0,2,0,0,0,0|1,1,0]=4 984 B13R2.13083 O=C1Cc2cc(c(cc2N1)F)O 271570a_203496583355_100000727509 [0,2,0,0,0,0|1,1,0]=4 985 B13R2.13083 O=C1Cc2cc(c(cc2N1)O)F 271570a_203496583355_200010218348 [0,2,0,0,0,0|1,1,0]=4 986 B9R1.6 C=C(C)c1ccccc1 271570a_100000694244_100000210277 [0,0,1,0,1,0|2,0,0]=4 987 B9R1.6 CC(=O)c1ccccc1 1458a_100000185807_200000210301 [0,0,1,0,1,0|1,1,0]=4 988 B9R1.6 [13CH3]C(=O)c1ccccc1 1458a_100000185807_200025704644 [0,0,1,0,1,0|1,1,0]=4 989 B11R1.91 C=C(C)CNc1ccccc1 34a_100000106764_100000748629 [0,0,1,0,0,1|2,0,0]=4 990 B11R1.91 C=C(C)CSc1ccccc1 62a_100000719477_100000211660 [0,0,1,0,0,1|2,0,0]=4 991 B11R1.91 C=C(C)CSc1ccccc1 62a_100000748629_100000041952 [0,0,1,0,0,1|2,0,0]=4 992 B11R1.91 C=C(F)CNc1ccccc1 34a_100000106764_100009893438 [0,0,1,0,0,1|2,0,0]=4 993 B11R1.91 C=C(F)CSc1ccccc1 62a_100000042424_100000041952 [0,0,1,0,0,1|2,0,0]=4 994 B11R1.91 C=C(F)CSc1ccccc1 62a_100000719477_100000042424 [0,0,1,0,0,1|2,0,0]=4 995 B11R1.91 CC(=O)CSc1ccccc1 1458a_100000211596_200000210301 [0,0,1,0,0,1|1,1,0]=4 996 B11R1.91 CC(=O)NCc1ccccc1 11a_100015324214_100015343762 [0,0,1,0,0,1|1,1,0]=4 997 B11R1.91 CC(=O)NCc1ccccc1 1626a_100015324214_100015343762 [0,0,1,0,0,1|1,1,0]=4 998 B11R1.91 CC(=O)NCc1ccccc1 240690a_100015324214_100015343762 [0,0,1,0,0,1|1,1,0]=4 999 B11R1.91 CC(=O)NCc1ccccc1 527a_100015324214_100103153847 [0,0,1,0,0,1|1,1,0]=4 1000 B11R1.91 CC(=O)NNc1ccccc1 22a_100015195140_100000070787 [0,0,1,0,0,1|1,1,0]=4 1001 B11R1.91 NC(=O)CNc1ccccc1 34a_100000106764_100000187820 [0,0,1,0,0,1|1,1,0]=4 1002 B11R1.91 NC(=O)COc1ccccc1 34a_100000210340_100000187820 [0,0,1,0,0,1|0,2,0]=4 1003 B11R1.91 NC(=O)COc1ccccc1 7a_100000210340_100000187820 [0,0,1,0,0,1|0,2,0]=4 1004 B11R1.91 NC(=O)CSc1ccccc1 62a_100000719477_100000747473 [0,0,1,0,0,1|0,1,0]=3 1005 B11R1.91 NC(=O)CSc1ccccc1 62a_100000747473_100000041952 [0,0,1,0,0,1|0,1,0]=3 1006 B11R1.91 NC(=O)CSc1ccccn1 62a_100000747473_100011216584 [0,0,1,0,0,1|1,1,0]=4 1007 B11R1.91 NC(=O)CSc1ccccn1 62a_100011216584_100000747473 [0,0,1,0,0,1|1,1,0]=4 1008 B11R1.91 NC(=O)CSc1cccnc1 62a_100000210063_100000747473 [0,0,1,0,0,1|1,1,0]=4 1009 B11R1.91 NC(=O)CSc1cccnc1 62a_100000747473_100000210063 [0,0,1,0,0,1|1,1,0]=4 1010 B11R1.91 NC(=O)CSc1ccncc1 62a_100000728582_100000747473 [0,0,1,0,0,1|1,1,0]=4 1011 B11R1.91 NC(=O)CSc1ccncc1 62a_100000747473_100000728582 [0,0,1,0,0,1|1,1,0]=4 1012 B11R1.91 O=C([O-])CNc1ccccc1 34a_100000106764_100020667443 [0,0,1,0,0,1|0,2,0]=4 1013 B11R1.91 O=C([O-])CSc1ccccc1 62a_100000719477_100020667443 [0,0,1,0,0,1|1,1,0]=4 1014 B11R1.91 O=C([O-])CSc1ccccc1 62a_100020667443_100000041952 [0,0,1,0,0,1|1,1,0]=4 1015 B11R1.91 [13CH3]C(=O)CSc1ccccc1 1458a_100000211596_200025704644 [0,0,1,0,0,1|1,1,0]=4