0 B14R2.1008 CC(=Cc1ccc2c(c1)CCO2)C 271570a_100102525489_100000729065 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.1008 CC(=Cc1ccc2c(c1)OCC2)C 271570a_100102525489_100009818566 [0,0,0,0,0,0|2,0,2]=4 2 B14R2.1008 CC(=Cc1ccc2c(c1)OCO2)C 271570a_100102525489_100000688060 [0,0,0,0,0,0|1,0,2]=3 3 B14R2.1008 CC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200000210301 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.1008 CC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200000210301 [0,0,0,0,0,0|1,0,1]=2 5 B14R2.1008 CC(=O)Cc1ccc2ncoc2c1 1458a_100000070787_106359897996 [0,0,0,0,0,0|2,0,2]=4 6 B14R2.1008 CC(=O)Cc1ccc2occc2c1 1458a_100000096804_200000210301 [0,0,0,0,0,0|2,0,2]=4 7 B14R2.1008 CC(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200000210301 [0,0,0,0,0,0|2,0,2]=4 8 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 11a_100000736984_100015343762 [0,0,0,0,0,0|3,0,1]=4 9 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 1626a_100000736984_100015343762 [0,0,0,0,0,0|3,0,1]=4 10 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 22a_100000736984_100000070787 [0,0,0,0,0,0|3,0,1]=4 11 B14R2.1008 CC(=O)Nc1ccc2c(c1)CCO2 527a_100000736984_100103153847 [0,0,0,0,0,0|3,0,1]=4 12 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100015343762 [0,0,0,0,0,0|2,0,1]=3 13 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100015343762 [0,0,0,0,0,0|2,0,1]=3 14 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000070787 [0,0,0,0,0,0|2,0,1]=3 15 B14R2.1008 CC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100103153847 [0,0,0,0,0,0|2,0,1]=3 16 B14R2.1008 CC(C)Nc1ccc2c(c1)CCC2 2230a_100000211504_100000210206 [0,0,0,0,0,0|4,0,0]=4 17 B14R2.1008 CC(C)Nc1ccc2c(c1)CCC2 34a_100000211504_100000210206 [0,0,0,0,0,0|4,0,0]=4 18 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000210206 [0,0,0,0,0,0|3,0,0]=3 19 B14R2.1008 CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100000210206 [0,0,0,0,0,0|3,0,0]=3 20 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000210206 [0,0,0,0,0,0|2,0,0]=2 21 B14R2.1008 CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210206 [0,0,0,0,0,0|2,0,0]=2 22 B14R2.1008 CC(C)Nc1ccc2ccoc2c1 34a_100000102395_100000210206 [0,0,0,0,0,0|3,0,1]=4 23 B14R2.1008 CC(C)Nc1ccc2cnoc2c1 34a_100000084182_100000210206 [0,0,0,0,0,0|4,0,0]=4 24 B14R2.1008 CC(C)Nc1ccc2ncoc2c1 34a_100011248239_100000210206 [0,0,0,0,0,0|3,0,1]=4 25 B14R2.1008 CC(C)Nc1ccc2occc2c1 34a_106430523501_100000210206 [0,0,0,0,0,0|3,0,1]=4 26 B14R2.1008 CC(C)Nc1ccc2ocnc2c1 34a_100011219863_100000210206 [0,0,0,0,0,0|3,0,1]=4 27 B14R2.1008 CC(C)Nc1ccc2oncc2c1 34a_100000037595_100000210206 [0,0,0,0,0,0|4,0,0]=4 28 B14R2.1008 CC(C)Oc1ccc2c(c1)CCC2 34a_100000209987_100000210206 [0,0,0,0,0,0|4,0,0]=4 29 B14R2.1008 CC(C)Oc1ccc2c(c1)CCC2 7a_100000209987_100000210206 [0,0,0,0,0,0|4,0,0]=4 30 B14R2.1008 CC(C)Oc1ccc2c(c1)CCN2 34a_100020636429_100000210206 [0,0,0,0,0,0|4,0,0]=4 31 B14R2.1008 CC(C)Oc1ccc2c(c1)NCC2 34a_100020636427_100000210206 [0,0,0,0,0,0|4,0,0]=4 32 B14R2.1008 CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210206 [0,0,0,0,0,0|2,0,0]=2 33 B14R2.1008 CC(C)Oc1ccc2ccoc2c1 34a_100000089557_100000210206 [0,0,0,0,0,0|3,0,1]=4 34 B14R2.1008 CC(C)Oc1ccc2ccoc2c1 7a_100000089557_100000210206 [0,0,0,0,0,0|3,0,1]=4 35 B14R2.1008 CC(C)Oc1ccc2cnoc2c1 34a_100000098417_100000210206 [0,0,0,0,0,0|4,0,0]=4 36 B14R2.1008 CC(C)Oc1ccc2cnoc2c1 7a_100000098417_100000210206 [0,0,0,0,0,0|4,0,0]=4 37 B14R2.1008 CC(C)Oc1ccc2occc2c1 34a_100000070125_100000210206 [0,0,0,0,0,0|3,0,1]=4 38 B14R2.1008 CC(C)Oc1ccc2occc2c1 7a_100000070125_100000210206 [0,0,0,0,0,0|3,0,1]=4 39 B14R2.1008 CC(C)Sc1cc2c(cn1)OCC2 62a_100000210206_102495363667 [0,0,0,0,0,0|4,0,0]=4 40 B14R2.1008 CC(C)Sc1cc2c(cn1)OCC2 62a_102495363667_100000210206 [0,0,0,0,0,0|4,0,0]=4 41 B14R2.1008 CC(C)Sc1ccc2c(c1)CCC2 62a_100000210206_100000745594 [0,0,0,0,0,0|4,0,0]=4 42 B14R2.1008 CC(C)Sc1ccc2c(c1)CCC2 62a_100000745594_100000210206 [0,0,0,0,0,0|4,0,0]=4 43 B14R2.1008 CC(C)Sc1ccc2c(c1)CCN2 62a_100000210206_100000691068 [0,0,0,0,0,0|4,0,0]=4 44 B14R2.1008 CC(C)Sc1ccc2c(c1)CCN2 62a_100000691068_100000210206 [0,0,0,0,0,0|4,0,0]=4 45 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000210206_100000729065 [0,0,0,0,0,0|3,0,0]=3 46 B14R2.1008 CC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000210206 [0,0,0,0,0,0|3,0,0]=3 47 B14R2.1008 CC(C)Sc1ccc2c(c1)NCC2 62a_100000210206_100000754641 [0,0,0,0,0,0|4,0,0]=4 48 B14R2.1008 CC(C)Sc1ccc2c(c1)NCC2 62a_100000754641_100000210206 [0,0,0,0,0,0|4,0,0]=4 49 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100000210206_100009818566 [0,0,0,0,0,0|3,0,0]=3 50 B14R2.1008 CC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000210206 [0,0,0,0,0,0|3,0,0]=3 51 B14R2.1008 CC(C)Sc1ccc2ccoc2c1 62a_100000210206_100000759542 [0,0,0,0,0,0|3,0,1]=4 52 B14R2.1008 CC(C)Sc1ccc2cnoc2c1 62a_100000210206_100009817722 [0,0,0,0,0,0|4,0,0]=4 53 B14R2.1008 CC(C)Sc1ccc2ncoc2c1 62a_100000210206_100009817590 [0,0,0,0,0,0|3,0,1]=4 54 B14R2.1008 CC(C)Sc1ccc2occc2c1 62a_100000210206_100000691453 [0,0,0,0,0,0|3,0,1]=4 55 B14R2.1008 CC(C)Sc1ccc2ocnc2c1 62a_100000210206_100009816175 [0,0,0,0,0,0|3,0,1]=4 56 B14R2.1008 CC(C)Sc1ccc2oncc2c1 62a_100000210206_100009817723 [0,0,0,0,0,0|4,0,0]=4 57 B14R2.1008 CN(C)Cc1ccc2c(c1)CCC2 270004a_100102631434_100000765347 [0,0,0,0,0,0|4,0,0]=4 58 B14R2.1008 CN(C)Cc1ccc2c(c1)CCO2 270004a_100102631434_100011218456 [0,0,0,0,0,0|3,0,0]=3 59 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_200000210301 [0,0,0,0,0,0|2,0,0]=2 60 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_200000210301 [0,0,0,0,0,0|2,0,0]=2 61 B14R2.1008 CN(C)Cc1ccc2c(c1)OCO2 269982a_100102631434_100000189651 [0,0,0,0,0,0|2,0,0]=2 62 B14R2.1008 CN(C)Cc1ccc2ncoc2c1 2230a_100102631434_106359897996 [0,0,0,0,0,0|3,0,1]=4 63 B14R2.1008 CN(C)Cc1ccc2ncoc2c1 270004a_100102631434_100000059852 [0,0,0,0,0,0|3,0,1]=4 64 B14R2.1008 CN(C)Cc1ccc2occc2c1 270004a_100102631434_100000040644 [0,0,0,0,0,0|3,0,1]=4 65 B14R2.1008 CN(C)Cc1ccc2ocnc2c1 2230a_100102631434_200010203175 [0,0,0,0,0,0|3,0,1]=4 66 B14R2.1008 CN(C)Cc1ccc2ocnc2c1 270004a_100102631434_100010271902 [0,0,0,0,0,0|3,0,1]=4 67 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 2230a_100000186720_200025704644 [0,0,0,0,0,0|2,0,0]=2 68 B14R2.1008 CN([13CH3])Cc1ccc2c(c1)OCO2 269982a_100000186720_200025704644 [0,0,0,0,0,0|2,0,0]=2 69 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_200025704644 [0,0,0,0,0,0|2,0,1]=3 70 B14R2.1008 [13CH3]C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_200025704644 [0,0,0,0,0,0|1,0,1]=2 71 B14R2.1008 [13CH3]C(=O)Cc1ccc2occc2c1 1458a_100000096804_200025704644 [0,0,0,0,0,0|2,0,2]=4 72 B14R2.1008 [13CH3]C(=O)Cc1ccc2ocnc2c1 1458a_100000081516_200025704644 [0,0,0,0,0,0|2,0,2]=4 73 B13R2.449 C=C=Cc1ccc2c(c1)OCO2 271570a_100015277604_100000688060 [1,0,0,0,0,0|0,0,3]=4 74 B13R2.449 CC=Cc1ccc2c(c1)CCO2 271570a_100016259895_100000729065 [1,0,0,0,0,0|1,0,2]=4 75 B13R2.449 CC=Cc1ccc2c(c1)OCC2 271570a_100016259895_100009818566 [1,0,0,0,0,0|1,0,2]=4 76 B13R2.449 CC=Cc1ccc2c(c1)OCO2 271570a_100016259895_100000688060 [1,0,0,0,0,0|0,0,2]=3 77 B13R2.449 CCNc1ccc2c(c1)CCC2 2230a_100000211504_100000210202 [1,0,0,0,0,0|3,0,0]=4 78 B13R2.449 CCNc1ccc2c(c1)CCC2 34a_100000211504_100000210202 [1,0,0,0,0,0|3,0,0]=4 79 B13R2.449 CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210202 [1,0,0,0,0,0|2,0,0]=3 80 B13R2.449 CCNc1ccc2c(c1)CCO2 34a_100000736984_100000210202 [1,0,0,0,0,0|2,0,0]=3 81 B13R2.449 CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210202 [1,0,0,0,0,0|1,0,0]=2 82 B13R2.449 CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210202 [1,0,0,0,0,0|1,0,0]=2 83 B13R2.449 CCNc1ccc2ccoc2c1 34a_100000102395_100000210202 [1,0,0,0,0,0|2,0,1]=4 84 B13R2.449 CCNc1ccc2cnoc2c1 34a_100000084182_100000210202 [1,0,0,0,0,0|3,0,0]=4 85 B13R2.449 CCNc1ccc2ncoc2c1 34a_100011248239_100000210202 [1,0,0,0,0,0|2,0,1]=4 86 B13R2.449 CCNc1ccc2occc2c1 34a_106430523501_100000210202 [1,0,0,0,0,0|2,0,1]=4 87 B13R2.449 CCNc1ccc2ocnc2c1 34a_100011219863_100000210202 [1,0,0,0,0,0|2,0,1]=4 88 B13R2.449 CCNc1ccc2oncc2c1 34a_100000037595_100000210202 [1,0,0,0,0,0|3,0,0]=4 89 B13R2.449 CCOc1ccc2c(c1)CCC2 34a_100000209987_100000210202 [1,0,0,0,0,0|3,0,0]=4 90 B13R2.449 CCOc1ccc2c(c1)CCC2 7a_100000209987_100000210202 [1,0,0,0,0,0|3,0,0]=4 91 B13R2.449 CCOc1ccc2c(c1)CCN2 34a_100020636429_100000210202 [1,0,0,0,0,0|3,0,0]=4 92 B13R2.449 CCOc1ccc2c(c1)NCC2 34a_100020636427_100000210202 [1,0,0,0,0,0|3,0,0]=4 93 B13R2.449 CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210202 [1,0,0,0,0,0|1,0,0]=2 94 B13R2.449 CCOc1ccc2ccoc2c1 34a_100000089557_100000210202 [1,0,0,0,0,0|2,0,1]=4 95 B13R2.449 CCOc1ccc2ccoc2c1 7a_100000089557_100000210202 [1,0,0,0,0,0|2,0,1]=4 96 B13R2.449 CCOc1ccc2cnoc2c1 34a_100000098417_100000210202 [1,0,0,0,0,0|3,0,0]=4 97 B13R2.449 CCOc1ccc2cnoc2c1 7a_100000098417_100000210202 [1,0,0,0,0,0|3,0,0]=4 98 B13R2.449 CCOc1ccc2occc2c1 34a_100000070125_100000210202 [1,0,0,0,0,0|2,0,1]=4 99 B13R2.449 CCOc1ccc2occc2c1 7a_100000070125_100000210202 [1,0,0,0,0,0|2,0,1]=4 100 B13R2.449 CCSc1cc2c(cn1)OCC2 62a_100000210202_102495363667 [1,0,0,0,0,0|3,0,0]=4 101 B13R2.449 CCSc1cc2c(cn1)OCC2 62a_102495363667_100000210202 [1,0,0,0,0,0|3,0,0]=4 102 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000210202_100000745594 [1,0,0,0,0,0|3,0,0]=4 103 B13R2.449 CCSc1ccc2c(c1)CCC2 62a_100000745594_100000210202 [1,0,0,0,0,0|3,0,0]=4 104 B13R2.449 CCSc1ccc2c(c1)CCN2 62a_100000210202_100000691068 [1,0,0,0,0,0|3,0,0]=4 105 B13R2.449 CCSc1ccc2c(c1)CCN2 62a_100000691068_100000210202 [1,0,0,0,0,0|3,0,0]=4 106 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000210202_100000729065 [1,0,0,0,0,0|2,0,0]=3 107 B13R2.449 CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210202 [1,0,0,0,0,0|2,0,0]=3 108 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000210202_100000754641 [1,0,0,0,0,0|3,0,0]=4 109 B13R2.449 CCSc1ccc2c(c1)NCC2 62a_100000754641_100000210202 [1,0,0,0,0,0|3,0,0]=4 110 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100000210202_100009818566 [1,0,0,0,0,0|2,0,0]=3 111 B13R2.449 CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210202 [1,0,0,0,0,0|2,0,0]=3 112 B13R2.449 CCSc1ccc2ccoc2c1 62a_100000210202_100000759542 [1,0,0,0,0,0|2,0,1]=4 113 B13R2.449 CCSc1ccc2cnoc2c1 62a_100000210202_100009817722 [1,0,0,0,0,0|3,0,0]=4 114 B13R2.449 CCSc1ccc2ncoc2c1 62a_100000210202_100009817590 [1,0,0,0,0,0|2,0,1]=4 115 B13R2.449 CCSc1ccc2occc2c1 62a_100000210202_100000691453 [1,0,0,0,0,0|2,0,1]=4 116 B13R2.449 CCSc1ccc2ocnc2c1 62a_100000210202_100009816175 [1,0,0,0,0,0|2,0,1]=4 117 B13R2.449 CCSc1ccc2oncc2c1 62a_100000210202_100009817723 [1,0,0,0,0,0|3,0,0]=4 118 B13R2.449 CNCc1ccc2c(c1)CCC2 207a_100102657272_100000765347 [1,0,0,0,0,0|3,0,0]=4 119 B13R2.449 CNCc1ccc2c(c1)CCC2 26a_100102657272_100000209987 [1,0,0,0,0,0|3,0,0]=4 120 B13R2.449 CNCc1ccc2c(c1)CCC2 270004a_106832991635_100000765347 [1,0,0,0,0,0|3,0,0]=4 121 B13R2.449 CNCc1ccc2c(c1)CCO2 207a_100102657272_100011218456 [1,0,0,0,0,0|2,0,0]=3 122 B13R2.449 CNCc1ccc2c(c1)CCO2 2230a_100011219410_200000210301 [1,0,0,0,0,0|2,0,0]=3 123 B13R2.449 CNCc1ccc2c(c1)CCO2 270004a_106832991635_100011218456 [1,0,0,0,0,0|2,0,0]=3 124 B13R2.449 CNCc1ccc2c(c1)CCO2 34a_100011219410_200000210301 [1,0,0,0,0,0|2,0,0]=3 125 B13R2.449 CNCc1ccc2c(c1)OCO2 2230a_100000210006_200000210301 [1,0,0,0,0,0|1,0,0]=2 126 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100000210006_200000210301 [1,0,0,0,0,0|1,0,0]=2 127 B13R2.449 CNCc1ccc2c(c1)OCO2 34a_100102657272_100000189651 [1,0,0,0,0,0|1,0,0]=2 128 B13R2.449 CNCc1ccc2c(c1)OCO2 7a_106832991635_100000189651 [1,0,0,0,0,0|1,0,0]=2 129 B13R2.449 CNCc1ccc2cnoc2c1 26a_100102657272_100000098417 [1,0,0,0,0,0|3,0,0]=4 130 B13R2.449 CNCc1ccc2ncoc2c1 207a_100102657272_100000059852 [1,0,0,0,0,0|2,0,1]=4 131 B13R2.449 CNCc1ccc2ncoc2c1 2230a_106832991635_106359897996 [1,0,0,0,0,0|2,0,1]=4 132 B13R2.449 CNCc1ccc2ncoc2c1 270004a_106832991635_100000059852 [1,0,0,0,0,0|2,0,1]=4 133 B13R2.449 CNCc1ccc2ncoc2c1 34a_100102657272_106359897996 [1,0,0,0,0,0|2,0,1]=4 134 B13R2.449 CNCc1ccc2ncoc2c1 7a_106832991635_106359897996 [1,0,0,0,0,0|2,0,1]=4 135 B13R2.449 CNCc1ccc2occc2c1 207a_100102657272_100000040644 [1,0,0,0,0,0|2,0,1]=4 136 B13R2.449 CNCc1ccc2occc2c1 2230a_100020591328_200000210301 [1,0,0,0,0,0|2,0,1]=4 137 B13R2.449 CNCc1ccc2occc2c1 26a_100102657272_100000070125 [1,0,0,0,0,0|2,0,1]=4 138 B13R2.449 CNCc1ccc2occc2c1 270004a_106832991635_100000040644 [1,0,0,0,0,0|2,0,1]=4 139 B13R2.449 CNCc1ccc2occc2c1 34a_100020591328_200000210301 [1,0,0,0,0,0|2,0,1]=4 140 B13R2.449 CNCc1ccc2ocnc2c1 207a_100102657272_100010271902 [1,0,0,0,0,0|2,0,1]=4 141 B13R2.449 CNCc1ccc2ocnc2c1 2230a_106832991635_200010203175 [1,0,0,0,0,0|2,0,1]=4 142 B13R2.449 CNCc1ccc2ocnc2c1 270004a_106832991635_100010271902 [1,0,0,0,0,0|2,0,1]=4 143 B13R2.449 CNCc1ccc2ocnc2c1 34a_100102657272_200010203175 [1,0,0,0,0,0|2,0,1]=4 144 B13R2.449 CNCc1ccc2ocnc2c1 7a_106832991635_200010203175 [1,0,0,0,0,0|2,0,1]=4 145 B13R2.449 COCc1ccc2c(c1)CCC2 34a_200000765175_200000210301 [1,0,0,0,0,0|3,0,0]=4 146 B13R2.449 COCc1ccc2c(c1)CCC2 7a_200000765175_200000210301 [1,0,0,0,0,0|3,0,0]=4 147 B13R2.449 COCc1ccc2c(c1)CCO2 34a_100011219353_200000210301 [1,0,0,0,0,0|2,0,0]=3 148 B13R2.449 COCc1ccc2c(c1)CCO2 7a_100011219353_200000210301 [1,0,0,0,0,0|2,0,0]=3 149 B13R2.449 COCc1ccc2c(c1)NCC2 34a_100000694088_200000210301 [1,0,0,0,0,0|3,0,0]=4 150 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100000210967_200000210301 [1,0,0,0,0,0|1,0,0]=2 151 B13R2.449 COCc1ccc2c(c1)OCO2 34a_100138415774_100000189651 [1,0,0,0,0,0|1,0,0]=2 152 B13R2.449 COCc1ccc2ccoc2c1 34a_200009859634_200000210301 [1,0,0,0,0,0|2,0,1]=4 153 B13R2.449 COCc1ccc2ccoc2c1 7a_200009859634_200000210301 [1,0,0,0,0,0|2,0,1]=4 154 B13R2.449 COCc1ccc2ncoc2c1 34a_100138415774_106359897996 [1,0,0,0,0,0|2,0,1]=4 155 B13R2.449 COCc1ccc2occc2c1 34a_100000067418_200000210301 [1,0,0,0,0,0|2,0,1]=4 156 B13R2.449 COCc1ccc2occc2c1 7a_100000067418_200000210301 [1,0,0,0,0,0|2,0,1]=4 157 B13R2.449 COCc1ccc2ocnc2c1 34a_100138415774_200010203175 [1,0,0,0,0,0|2,0,1]=4 158 B13R2.449 CSCc1ccc2ncoc2c1 62a_106359897996_200000210301 [1,0,0,0,0,0|2,0,1]=4 159 B13R2.449 CSCc1ccc2ncoc2c1 62a_200000210301_106359897996 [1,0,0,0,0,0|2,0,1]=4 160 B13R2.449 CSCc1ccc2ocnc2c1 62a_200000210301_200010203175 [1,0,0,0,0,0|2,0,1]=4 161 B13R2.449 FCNc1ccc2c(c1)CCO2 34a_100000736984_100015361967 [1,0,0,0,0,0|3,0,0]=4 162 B13R2.449 FCNc1ccc2c(c1)OCO2 34a_100000209953_100015361967 [1,0,0,0,0,0|2,0,0]=3 163 B13R2.449 FCOc1ccc2c(c1)OCO2 34a_100000210298_100015361967 [1,0,0,0,0,0|2,0,0]=3 164 B13R2.449 FCSc1ccc2c(c1)CCO2 62a_100000729065_100015361967 [1,0,0,0,0,0|3,0,0]=4 165 B13R2.449 FCSc1ccc2c(c1)CCO2 62a_100015361967_100000729065 [1,0,0,0,0,0|3,0,0]=4 166 B13R2.449 FCSc1ccc2c(c1)OCC2 62a_100009818566_100015361967 [1,0,0,0,0,0|3,0,0]=4 167 B13R2.449 FCSc1ccc2c(c1)OCC2 62a_100015361967_100009818566 [1,0,0,0,0,0|3,0,0]=4 168 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 2230a_100011219410_200025704644 [1,0,0,0,0,0|2,0,0]=3 169 B13R2.449 [13CH3]NCc1ccc2c(c1)CCO2 34a_100011219410_200025704644 [1,0,0,0,0,0|2,0,0]=3 170 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 2230a_100000210006_200025704644 [1,0,0,0,0,0|1,0,0]=2 171 B13R2.449 [13CH3]NCc1ccc2c(c1)OCO2 34a_100000210006_200025704644 [1,0,0,0,0,0|1,0,0]=2 172 B13R2.449 [13CH3]NCc1ccc2occc2c1 2230a_100020591328_200025704644 [1,0,0,0,0,0|2,0,1]=4 173 B13R2.449 [13CH3]NCc1ccc2occc2c1 34a_100020591328_200025704644 [1,0,0,0,0,0|2,0,1]=4 174 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 34a_200000765175_200025704644 [1,0,0,0,0,0|3,0,0]=4 175 B13R2.449 [13CH3]OCc1ccc2c(c1)CCC2 7a_200000765175_200025704644 [1,0,0,0,0,0|3,0,0]=4 176 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 34a_100011219353_200025704644 [1,0,0,0,0,0|2,0,0]=3 177 B13R2.449 [13CH3]OCc1ccc2c(c1)CCO2 7a_100011219353_200025704644 [1,0,0,0,0,0|2,0,0]=3 178 B13R2.449 [13CH3]OCc1ccc2c(c1)NCC2 34a_100000694088_200025704644 [1,0,0,0,0,0|3,0,0]=4 179 B13R2.449 [13CH3]OCc1ccc2c(c1)OCO2 34a_100000210967_200025704644 [1,0,0,0,0,0|1,0,0]=2 180 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 34a_200009859634_200025704644 [1,0,0,0,0,0|2,0,1]=4 181 B13R2.449 [13CH3]OCc1ccc2ccoc2c1 7a_200009859634_200025704644 [1,0,0,0,0,0|2,0,1]=4 182 B13R2.449 [13CH3]OCc1ccc2occc2c1 34a_100000067418_200025704644 [1,0,0,0,0,0|2,0,1]=4 183 B13R2.449 [13CH3]OCc1ccc2occc2c1 7a_100000067418_200025704644 [1,0,0,0,0,0|2,0,1]=4 184 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_106359897996_200025704644 [1,0,0,0,0,0|2,0,1]=4 185 B13R2.449 [13CH3]SCc1ccc2ncoc2c1 62a_200025704644_106359897996 [1,0,0,0,0,0|2,0,1]=4 186 B13R2.449 [13CH3]SCc1ccc2ocnc2c1 62a_200025704644_200010203175 [1,0,0,0,0,0|2,0,1]=4 187 B15R2.926 CC(C)Nc1ccc2c(c1)CC(O2)C 2230a_100102713350_100000210206 [0,1,0,0,0,0|3,0,0]=4 188 B15R2.926 CC(C)Nc1ccc2c(c1)CC(O2)C 34a_100102713350_100000210206 [0,1,0,0,0,0|3,0,0]=4 189 B15R2.964 CC(=Cc1cc2c(cc1N)OCO2)C 271570a_100102525489_100012557033 [0,1,0,0,0,0|1,0,2]=4 190 B15R2.964 CC(=Cc1cc2c(cc1O)OCO2)C 271570a_100102525489_100010290809 [0,1,0,0,0,0|1,0,2]=4 191 B15R2.964 CC(=O)Cc1cc2c(cc1Br)OCO2 1458a_100000070787_100009995336 [0,1,0,0,0,0|1,0,1]=3 192 B15R2.964 CC(=O)Cc1cc2c(cc1Cl)OCO2 1458a_100000070787_100000043460 [0,1,0,0,0,0|1,0,1]=3 193 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 11a_100000066439_100015343762 [0,1,0,0,0,0|2,0,1]=4 194 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 1626a_100000066439_100015343762 [0,1,0,0,0,0|2,0,1]=4 195 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 22a_100000066439_100000070787 [0,1,0,0,0,0|2,0,1]=4 196 B15R2.964 CC(=O)Nc1cc2c(cc1C)OCO2 527a_100000066439_100103153847 [0,1,0,0,0,0|2,0,1]=4 197 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 11a_100000234339_100015343762 [0,1,0,0,0,0|2,0,1]=4 198 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 1626a_100000234339_100015343762 [0,1,0,0,0,0|2,0,1]=4 199 B15R2.964 CC(=O)Nc1cc2c(cc1Cl)OCO2 22a_100000234339_100000070787 [0,1,0,0,0,0|2,0,1]=4 200 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 11a_100012557033_100015343762 [0,1,0,0,0,0|2,0,1]=4 201 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 1626a_100012557033_100015343762 [0,1,0,0,0,0|2,0,1]=4 202 B15R2.964 CC(=O)Nc1cc2c(cc1I)OCO2 22a_100012557033_100000070787 [0,1,0,0,0,0|2,0,1]=4 203 B15R2.964 CC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210206 [0,1,0,0,0,0|2,0,0]=3 204 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100000210206 [0,1,0,0,0,0|2,0,0]=3 205 B15R2.964 CC(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000210206 [0,1,0,0,0,0|2,0,0]=3 206 B15R2.964 CC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000210206 [0,1,0,0,0,0|2,0,0]=3 207 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 2230a_100102631434_100009995336 [0,1,0,0,0,0|2,0,0]=3 208 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 269982a_100102631434_100009995336 [0,1,0,0,0,0|2,0,0]=3 209 B15R2.964 CN(C)Cc1cc2c(cc1Br)OCO2 270004a_100102631434_100000186749 [0,1,0,0,0,0|2,0,0]=3 210 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100102631434_100000043460 [0,1,0,0,0,0|2,0,0]=3 211 B15R2.964 CN(C)Cc1cc2c(cc1Cl)OCO2 270004a_100102631434_100000015535 [0,1,0,0,0,0|2,0,0]=3 212 B15R2.964 Cc1cc2c(cc1CN(C)C)OCO2 269982a_100102631434_200000112958 [0,1,0,0,0,0|2,0,0]=3 213 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 2230a_100000066439_100000210206 [0,1,0,0,0,0|2,0,0]=3 214 B15R2.964 Cc1cc2c(cc1NC(C)C)OCO2 34a_100000066439_100000210206 [0,1,0,0,0,0|2,0,0]=3 215 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 34a_100000145572_100000210206 [0,1,0,0,0,0|2,0,0]=3 216 B15R2.964 Cc1cc2c(cc1OC(C)C)OCO2 7a_100000145572_100000210206 [0,1,0,0,0,0|2,0,0]=3 217 B15R2.4239 CC(=C(C)c1ccc2c(c1)OCO2)C 271570a_200000049429_100000688060 [0,1,0,0,0,0|1,0,2]=4 218 B15R2.4239 CC(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200000210301 [0,1,0,0,0,0|1,0,1]=3 219 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210206 [0,1,0,0,0,0|2,0,1]=4 220 B15R2.4239 CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210206 [0,1,0,0,0,0|1,0,1]=3 221 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 11a_100102631434_100000210863 [0,1,0,0,0,0|2,0,1]=4 222 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 1626a_100102631434_100000210863 [0,1,0,0,0,0|2,0,1]=4 223 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 240690a_100102631434_100000210863 [0,1,0,0,0,0|2,0,1]=4 224 B15R2.4239 CN(C)C(=O)c1ccc2c(c1)OCO2 527a_100102631434_100000210863 [0,1,0,0,0,0|2,0,1]=4 225 B15R2.4239 [13CH3]C(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_200025704644 [0,1,0,0,0,0|1,0,1]=3 226 B15R2.4343 C#CC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_200000035995 [0,1,0,0,0,0|3,0,0]=4 227 B15R2.4343 C#CC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_200000035995 [0,1,0,0,0,0|2,0,0]=3 228 B15R2.4343 C#CC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_200000035995 [0,1,0,0,0,0|2,0,0]=3 229 B15R2.4343 C#CC(C)Sc1ccc2c(c1)CCO2 62a_200000035995_100000729065 [0,1,0,0,0,0|3,0,0]=4 230 B15R2.4343 C#CC(C)Sc1ccc2c(c1)OCC2 62a_200000035995_100009818566 [0,1,0,0,0,0|3,0,0]=4 231 B15R2.4343 C=CC(C)Sc1ccc2c(c1)CCO2 62a_100011215867_100000729065 [0,1,0,0,0,0|3,0,0]=4 232 B15R2.4343 C=CC(C)Sc1ccc2c(c1)OCC2 62a_100011215867_100009818566 [0,1,0,0,0,0|3,0,0]=4 233 B15R2.4343 CC(C#N)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000184139 [0,1,0,0,0,0|2,0,1]=4 234 B15R2.4343 CC(C#N)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000184139 [0,1,0,0,0,0|1,0,1]=3 235 B15R2.4343 CC(C#N)Sc1ccc2c(c1)CCO2 62a_100000703298_100000729065 [0,1,0,0,0,0|2,0,1]=4 236 B15R2.4343 CC(C#N)Sc1ccc2c(c1)CCO2 62a_100000729065_100000703298 [0,1,0,0,0,0|2,0,1]=4 237 B15R2.4343 CC(C#N)Sc1ccc2c(c1)OCC2 62a_100000703298_100009818566 [0,1,0,0,0,0|2,0,1]=4 238 B15R2.4343 CC(C#N)Sc1ccc2c(c1)OCC2 62a_100009818566_100000703298 [0,1,0,0,0,0|2,0,1]=4 239 B15R2.4343 CC(CO)Nc1ccc2c(c1)CCO2 2230a_100000736984_100012180447 [0,1,0,0,0,0|3,0,0]=4 240 B15R2.4343 CC(CO)Nc1ccc2c(c1)CCO2 34a_100000736984_100012180447 [0,1,0,0,0,0|3,0,0]=4 241 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 2230a_100000209953_100012180447 [0,1,0,0,0,0|2,0,0]=3 242 B15R2.4343 CC(CO)Nc1ccc2c(c1)OCO2 34a_100000209953_100012180447 [0,1,0,0,0,0|2,0,0]=3 243 B15R2.4343 CC(CO)Oc1ccc2c(c1)OCO2 34a_100000210298_100012180447 [0,1,0,0,0,0|2,0,0]=3 244 B15R2.4343 CC(CO)Sc1ccc2c(c1)CCO2 62a_100012180447_100000729065 [0,1,0,0,0,0|3,0,0]=4 245 B15R2.4343 CC(CO)Sc1ccc2c(c1)OCC2 62a_100012180447_100009818566 [0,1,0,0,0,0|3,0,0]=4 246 B15R2.4343 CCC(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_100000210202 [0,1,0,0,0,0|2,0,1]=4 247 B15R2.4343 CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210202 [0,1,0,0,0,0|1,0,1]=3 248 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000210414 [0,1,0,0,0,0|2,0,1]=4 249 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000210414 [0,1,0,0,0,0|2,0,1]=4 250 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000210414 [0,1,0,0,0,0|2,0,1]=4 251 B15R2.4343 CCC(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100000210414 [0,1,0,0,0,0|2,0,1]=4 252 B15R2.4343 CCC(C)Nc1ccc2c(c1)CCO2 2230a_100000736984_100000758301 [0,1,0,0,0,0|3,0,0]=4 253 B15R2.4343 CCC(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100011215416 [0,1,0,0,0,0|3,0,0]=4 254 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000758301 [0,1,0,0,0,0|2,0,0]=3 255 B15R2.4343 CCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100011215416 [0,1,0,0,0,0|2,0,0]=3 256 B15R2.4343 CCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100011215416 [0,1,0,0,0,0|2,0,0]=3 257 B15R2.4343 CCC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000758301 [0,1,0,0,0,0|3,0,0]=4 258 B15R2.4343 CCC(C)Sc1ccc2c(c1)CCO2 62a_100000758301_100000729065 [0,1,0,0,0,0|3,0,0]=4 259 B15R2.4343 CCC(C)Sc1ccc2c(c1)OCC2 62a_100000758301_100009818566 [0,1,0,0,0,0|3,0,0]=4 260 B15R2.4343 CCC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000758301 [0,1,0,0,0,0|3,0,0]=4 261 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210202 [0,1,0,0,0,0|2,0,0]=3 262 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000204670 [0,1,0,0,0,0|2,0,0]=3 263 B15R2.4343 CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000225621_100000189651 [0,1,0,0,0,0|2,0,0]=3 264 B15R2.4343 CN(CF)Cc1ccc2c(c1)OCO2 269982a_100000186720_100015361967 [0,1,0,0,0,0|2,0,0]=3 265 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 11a_106832991635_100000242752 [0,1,0,0,0,0|2,0,1]=4 266 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 1626a_100102657272_100000242752 [0,1,0,0,0,0|2,0,1]=4 267 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 240690a_100102657272_100000242752 [0,1,0,0,0,0|2,0,1]=4 268 B15R2.4343 CNC(=O)Cc1ccc2c(c1)CCO2 527a_100102657272_100000242752 [0,1,0,0,0,0|2,0,1]=4 269 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 11a_106832991635_100000743733 [0,1,0,0,0,0|1,0,1]=3 270 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 240690a_100102657272_100000743733 [0,1,0,0,0,0|1,0,1]=3 271 B15R2.4343 CNC(=O)Cc1ccc2c(c1)OCO2 527a_100102657272_100000743733 [0,1,0,0,0,0|1,0,1]=3 272 B15R2.4343 CNC(=O)Nc1ccc2c(c1)OCO2 2430a_100000209953_100102657272 [0,1,0,0,0,0|2,0,1]=4 273 B15R2.4343 COC(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100009879195 [0,1,0,0,0,0|3,0,0]=4 274 B15R2.4343 COC(C)Sc1ccc2c(c1)CCO2 62a_100009879195_100000729065 [0,1,0,0,0,0|3,0,0]=4 275 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100009879195 [0,1,0,0,0,0|3,0,0]=4 276 B15R2.4343 COC(C)Sc1ccc2c(c1)OCC2 62a_100009879195_100009818566 [0,1,0,0,0,0|3,0,0]=4 277 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)CCO2 62a_100000729065_100016084084 [0,1,0,0,0,0|3,0,0]=4 278 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)CCO2 62a_100016084084_100000729065 [0,1,0,0,0,0|3,0,0]=4 279 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)OCC2 62a_100009818566_100016084084 [0,1,0,0,0,0|3,0,0]=4 280 B15R2.4343 C[C@H](CO)Sc1ccc2c(c1)OCC2 62a_100016084084_100009818566 [0,1,0,0,0,0|3,0,0]=4 281 B15R2.4343 O=C(CF)Cc1ccc2c(c1)CCO2 1458a_100000242752_100015361967 [0,1,0,0,0,0|2,0,1]=4 282 B15R2.4343 O=C(CF)Cc1ccc2c(c1)OCO2 1458a_100000743733_100015361967 [0,1,0,0,0,0|1,0,1]=3 283 B15R2.4343 O=C(CO)Nc1ccc2c(c1)OCO2 22a_100000209953_100000210174 [0,1,0,0,0,0|2,0,1]=4 284 B15R2.4343 O=C(CO)Nc1ccc2c(c1)OCO2 527a_100000209953_100000210174 [0,1,0,0,0,0|2,0,1]=4 285 B15R2.9245 CC(C)Sc1ccc2c(c1)OCC2=O 62a_100000210206_100000686717 [0,1,0,0,0,0|3,0,0]=4 286 B15R2.9245 CC(C)Sc1ccc2c(c1)OCC2N 62a_100000210206_100020628175 [0,1,0,0,0,0|3,0,0]=4 287 B15R2.9245 CC(C)Sc1ccc2c(c1)OCC2N 62a_100020628175_100000210206 [0,1,0,0,0,0|3,0,0]=4 288 B15R2.14950 CN(C)Cc1cc(c2c(c1)CCO2)Br 270004a_100102631434_100009816904 [0,1,0,0,0,0|3,0,0]=4 289 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Br 270004a_100102631434_100000682445 [0,1,0,0,0,0|2,0,0]=3 290 B15R2.14950 CN(C)Cc1cc(c2c(c1)OCO2)Cl 270004a_100102631434_100000016197 [0,1,0,0,0,0|2,0,0]=3 291 B15R2.42998 CC(C)(C)Nc1ccc2c(c1)CCO2 34a_100000736984_100000210625 [0,1,0,0,0,0|3,0,0]=4 292 B15R2.42998 CC(C)(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000210625 [0,1,0,0,0,0|2,0,0]=3 293 B15R2.42998 CC(C)(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000210625 [0,1,0,0,0,0|2,0,0]=3 294 B15R2.42998 CC(C)(C)Sc1ccc2c(c1)CCO2 62a_100000211941_100000729065 [0,1,0,0,0,0|3,0,0]=4 295 B15R2.42998 CC(C)(C)Sc1ccc2c(c1)CCO2 62a_100000729065_100000211941 [0,1,0,0,0,0|3,0,0]=4 296 B15R2.42998 CC(C)(C)Sc1ccc2c(c1)OCC2 62a_100000211941_100009818566 [0,1,0,0,0,0|3,0,0]=4 297 B15R2.42998 CC(C)(C)Sc1ccc2c(c1)OCC2 62a_100009818566_100000211941 [0,1,0,0,0,0|3,0,0]=4 298 B15R2.42998 CS(=O)(=O)Nc1ccc2c(c1)OCO2 40a_100000209953_100000738038 [0,1,0,0,0,0|3,0,0]=4 299 B15R2.42998 FC(F)(F)Nc1ccc2c(c1)OCO2 34a_100000209953_200103152311 [0,1,0,0,0,0|3,0,0]=4 300 B15R2.42998 FC(F)(F)Oc1ccc2c(c1)OCO2 34a_100000210298_200103152311 [0,1,0,0,0,0|3,0,0]=4 301 B15R2.43323 CC(=Cc1ccc2c(c1C)OCO2)C 271570a_100102525489_100010335860 [0,1,0,0,0,0|1,0,2]=4 302 B15R2.43323 CC(=Cc1ccc2c(c1F)OCO2)C 271570a_100102525489_100010223184 [0,1,0,0,0,0|1,0,2]=4 303 B15R2.43323 CC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000210206 [0,1,0,0,0,0|2,0,0]=3 304 B15R2.43323 Cc1c(ccc2c1OCO2)SC(C)C 62a_100010335860_100000210206 [0,1,0,0,0,0|2,0,0]=3 305 B15R2.49965 CC(C)Sc1ccc2c(c1)C(=O)CO2 62a_100000210206_100000752586 [0,1,0,0,0,0|3,0,0]=4 306 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 34a_100010141077_200025704644 [0,0,1,0,0,0|2,0,1]=4 307 B13R1.35 CC(=O)Cc1ccc(c(c1)Br)O[13CH3] 7a_100010141077_200025704644 [0,0,1,0,0,0|2,0,1]=4 308 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 34a_200000080089_200025704644 [0,0,1,0,0,0|2,0,1]=4 309 B13R1.35 CC(=O)Cc1ccc(c(c1)C)O[13CH3] 7a_200000080089_200025704644 [0,0,1,0,0,0|2,0,1]=4 310 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 34a_200000080078_200025704644 [0,0,1,0,0,0|2,0,1]=4 311 B13R1.35 CC(=O)Cc1ccc(c(c1)Cl)O[13CH3] 7a_200000080078_200025704644 [0,0,1,0,0,0|2,0,1]=4 312 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100000070787_200011397701 [0,0,1,0,0,0|2,0,1]=4 313 B13R1.35 COc1ccc(cc1Br)CC(=O)C 1458a_100011202338_200000210301 [0,0,1,0,0,0|2,0,1]=4 314 B13R1.35 COc1ccc(cc1Br)CC(=O)C 34a_100010141077_200000210301 [0,0,1,0,0,0|2,0,1]=4 315 B13R1.35 COc1ccc(cc1Br)CC(=O)C 7a_100010141077_200000210301 [0,0,1,0,0,0|2,0,1]=4 316 B13R1.35 COc1ccc(cc1Br)CC(=O)[13CH3] 1458a_100011202338_200025704644 [0,0,1,0,0,0|2,0,1]=4 317 B13R1.35 COc1ccc(cc1Br)CN(C)C 2230a_100102631434_200011397701 [0,0,1,0,0,0|3,0,0]=4 318 B13R1.35 COc1ccc(cc1Br)CN(C)C 269982a_100102631434_200011397701 [0,0,1,0,0,0|3,0,0]=4 319 B13R1.35 COc1ccc(cc1Br)CN(C)C 270004a_100102631434_100000173361 [0,0,1,0,0,0|3,0,0]=4 320 B13R1.35 COc1ccc(cc1Br)NC(C)C 34a_100000187427_100000210206 [0,0,1,0,0,0|3,0,0]=4 321 B13R1.35 COc1ccc(cc1Br)OC(C)C 34a_100010234764_100000210206 [0,0,1,0,0,0|3,0,0]=4 322 B13R1.35 COc1ccc(cc1Br)OC(C)C 7a_100010234764_100000210206 [0,0,1,0,0,0|3,0,0]=4 323 B13R1.35 COc1ccc(cc1Br)SC(C)C 62a_100000210206_100011249507 [0,0,1,0,0,0|3,0,0]=4 324 B13R1.35 COc1ccc(cc1Br)SC(C)C 62a_100011249507_100000210206 [0,0,1,0,0,0|3,0,0]=4 325 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100000070787_200011290836 [0,0,1,0,0,0|2,0,1]=4 326 B13R1.35 COc1ccc(cc1C)CC(=O)C 1458a_100011356478_200000210301 [0,0,1,0,0,0|2,0,1]=4 327 B13R1.35 COc1ccc(cc1C)CC(=O)C 34a_200000080089_200000210301 [0,0,1,0,0,0|2,0,1]=4 328 B13R1.35 COc1ccc(cc1C)CC(=O)C 7a_200000080089_200000210301 [0,0,1,0,0,0|2,0,1]=4 329 B13R1.35 COc1ccc(cc1C)CC(=O)[13CH3] 1458a_100011356478_200025704644 [0,0,1,0,0,0|2,0,1]=4 330 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100000241087_200000210301 [0,0,1,0,0,0|3,0,0]=4 331 B13R1.35 COc1ccc(cc1C)CN(C)C 2230a_100102631434_200011290836 [0,0,1,0,0,0|3,0,0]=4 332 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100000241087_200000210301 [0,0,1,0,0,0|3,0,0]=4 333 B13R1.35 COc1ccc(cc1C)CN(C)C 269982a_100102631434_200011290836 [0,0,1,0,0,0|3,0,0]=4 334 B13R1.35 COc1ccc(cc1C)CN(C)C 270004a_100102631434_100000239718 [0,0,1,0,0,0|3,0,0]=4 335 B13R1.35 COc1ccc(cc1C)CN(C)C 34a_100000241087_200000210301 [0,0,1,0,0,0|3,0,0]=4 336 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 2230a_100000241087_200025704644 [0,0,1,0,0,0|3,0,0]=4 337 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 269982a_100000241087_200025704644 [0,0,1,0,0,0|3,0,0]=4 338 B13R1.35 COc1ccc(cc1C)CN(C)[13CH3] 34a_100000241087_200025704644 [0,0,1,0,0,0|3,0,0]=4 339 B13R1.35 COc1ccc(cc1C)NC(C)C 2230a_100000743268_100000210206 [0,0,1,0,0,0|3,0,0]=4 340 B13R1.35 COc1ccc(cc1C)NC(C)C 34a_100000743268_100000210206 [0,0,1,0,0,0|3,0,0]=4 341 B13R1.35 COc1ccc(cc1C)NC(C)C 7a_100000743268_100000210206 [0,0,1,0,0,0|3,0,0]=4 342 B13R1.35 COc1ccc(cc1C)OC(C)C 34a_100000759738_100000210206 [0,0,1,0,0,0|3,0,0]=4 343 B13R1.35 COc1ccc(cc1C)OC(C)C 7a_100000759738_100000210206 [0,0,1,0,0,0|3,0,0]=4 344 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100000210206_100011219705 [0,0,1,0,0,0|3,0,0]=4 345 B13R1.35 COc1ccc(cc1C)SC(C)C 62a_100011219705_100000210206 [0,0,1,0,0,0|3,0,0]=4 346 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100000070787_100000693707 [0,0,1,0,0,0|2,0,1]=4 347 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 1458a_100012026953_200000210301 [0,0,1,0,0,0|2,0,1]=4 348 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 34a_200000080078_200000210301 [0,0,1,0,0,0|2,0,1]=4 349 B13R1.35 COc1ccc(cc1Cl)CC(=O)C 7a_200000080078_200000210301 [0,0,1,0,0,0|2,0,1]=4 350 B13R1.35 COc1ccc(cc1Cl)CC(=O)[13CH3] 1458a_100012026953_200025704644 [0,0,1,0,0,0|2,0,1]=4 351 B13R1.35 COc1ccc(cc1Cl)CN(C)C 2230a_100102631434_100000693707 [0,0,1,0,0,0|3,0,0]=4 352 B13R1.35 COc1ccc(cc1Cl)CN(C)C 269982a_100102631434_100000693707 [0,0,1,0,0,0|3,0,0]=4 353 B13R1.35 COc1ccc(cc1Cl)CN(C)C 270004a_100102631434_100000186747 [0,0,1,0,0,0|3,0,0]=4 354 B13R1.35 COc1ccc(cc1Cl)NC(C)C 2230a_100000211044_100000210206 [0,0,1,0,0,0|3,0,0]=4 355 B13R1.35 COc1ccc(cc1Cl)NC(C)C 34a_100000211044_100000210206 [0,0,1,0,0,0|3,0,0]=4 356 B13R1.35 COc1ccc(cc1Cl)OC(C)C 34a_200009861682_100000210206 [0,0,1,0,0,0|3,0,0]=4 357 B13R1.35 COc1ccc(cc1Cl)OC(C)C 7a_200009861682_100000210206 [0,0,1,0,0,0|3,0,0]=4 358 B13R1.35 COc1ccc(cc1Cl)SC(C)C 62a_100000210206_100012355395 [0,0,1,0,0,0|3,0,0]=4 359 B13R1.35 COc1ccc(cc1Cl)SC(C)C 62a_100012355395_100000210206 [0,0,1,0,0,0|3,0,0]=4 360 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000070787_100000189595 [0,0,1,0,0,0|2,0,1]=4 361 B13R1.35 COc1ccc(cc1F)CC(=O)C 1458a_100000204603_200000210301 [0,0,1,0,0,0|2,0,1]=4 362 B13R1.35 COc1ccc(cc1F)CC(=O)[13CH3] 1458a_100000204603_200025704644 [0,0,1,0,0,0|2,0,1]=4 363 B13R1.35 COc1ccc(cc1F)CN(C)C 2230a_100102631434_100000189595 [0,0,1,0,0,0|3,0,0]=4 364 B13R1.35 COc1ccc(cc1F)CN(C)C 269982a_100102631434_100000189595 [0,0,1,0,0,0|3,0,0]=4 365 B13R1.35 COc1ccc(cc1F)CN(C)C 270004a_100102631434_100000204617 [0,0,1,0,0,0|3,0,0]=4 366 B13R1.35 COc1ccc(cc1F)NC(C)C 2230a_100000740183_100000210206 [0,0,1,0,0,0|3,0,0]=4 367 B13R1.35 COc1ccc(cc1F)NC(C)C 34a_100000740183_100000210206 [0,0,1,0,0,0|3,0,0]=4 368 B13R1.35 COc1ccc(cc1F)OC(C)C 34a_100000746305_100000210206 [0,0,1,0,0,0|3,0,0]=4 369 B13R1.35 COc1ccc(cc1F)OC(C)C 7a_100000746305_100000210206 [0,0,1,0,0,0|3,0,0]=4 370 B13R1.35 COc1ccc(cc1F)SC(C)C 62a_100000171752_100000210206 [0,0,1,0,0,0|3,0,0]=4 371 B13R1.35 COc1ccc(cc1F)SC(C)C 62a_100000210206_100000171752 [0,0,1,0,0,0|3,0,0]=4 372 B13R1.35 COc1ccc(cc1I)CN(C)C 270004a_100102631434_100009827998 [0,0,1,0,0,0|3,0,0]=4 373 B13R1.35 COc1ccc(cc1I)NC(C)C 34a_100011356947_100000210206 [0,0,1,0,0,0|3,0,0]=4 374 B13R1.35 COc1ccc(cc1I)OC(C)C 34a_100010084122_100000210206 [0,0,1,0,0,0|3,0,0]=4 375 B13R1.35 COc1ccc(cc1I)OC(C)C 7a_100010084122_100000210206 [0,0,1,0,0,0|3,0,0]=4 376 B13R1.35 COc1ccc(cc1N)SC(C)C 62a_100000210206_100011249504 [0,0,1,0,0,0|3,0,0]=4 377 B13R1.35 COc1ccc(cc1N)SC(C)C 62a_100011249504_100000210206 [0,0,1,0,0,0|3,0,0]=4 378 B13R1.35 COc1ccc(cc1O)C=C(C)C 271570a_100102525489_100009816560 [0,0,1,0,0,0|1,0,2]=4 379 B13R1.35 COc1ccc(cc1O)CC(=O)C 1458a_100000049095_200000210301 [0,0,1,0,0,0|1,0,1]=3 380 B13R1.35 COc1ccc(cc1O)CC(=O)C 271570a_203496583355_100011493462 [0,0,1,0,0,0|1,0,1]=3 381 B13R1.35 COc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000049095_200025704644 [0,0,1,0,0,0|1,0,1]=3 382 B13R1.35 COc1ccc(cc1O)CN(C)C 2230a_100000188468_200000210301 [0,0,1,0,0,0|2,0,0]=3 383 B13R1.35 COc1ccc(cc1O)CN(C)C 269982a_100000188468_200000210301 [0,0,1,0,0,0|2,0,0]=3 384 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 2230a_100000188468_200025704644 [0,0,1,0,0,0|2,0,0]=3 385 B13R1.35 COc1ccc(cc1O)CN(C)[13CH3] 269982a_100000188468_200025704644 [0,0,1,0,0,0|2,0,0]=3 386 B13R1.35 COc1ccc(cc1O)NC(=O)C 22a_100000211920_100000070787 [0,0,1,0,0,0|2,0,1]=4 387 B13R1.35 COc1ccc(cc1O)NC(=O)C 527a_100000211920_100103153847 [0,0,1,0,0,0|2,0,1]=4 388 B13R1.35 COc1ccc(cc1O)NC(C)C 34a_100000211920_100000210206 [0,0,1,0,0,0|2,0,0]=3 389 B13R1.35 COc1ccc(cc1O)SC(C)C 62a_100000210206_100009816560 [0,0,1,0,0,0|2,0,0]=3 390 B13R1.35 COc1cnc(cc1O)SC(C)C 62a_100000210206_100010264082 [0,0,1,0,0,0|3,0,0]=4 391 B13R1.35 COc1ncc(cc1O)SC(C)C 62a_100000210206_100010135713 [0,0,1,0,0,0|3,0,0]=4 392 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_100010141077_200025704644 [0,0,1,0,0,0|1,1,1]=4 393 B13R1.52 CC(=O)Cc1ccc(c(c1)S[13CH3])O 62a_200025704644_100010141077 [0,0,1,0,0,0|1,1,1]=4 394 B13R1.52 CCc1cc(ccc1O)SC(C)C 62a_100000210206_100012338938 [0,0,1,0,0,0|3,0,0]=4 395 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_100000070787_100010110085 [0,0,1,0,0,0|2,0,1]=4 396 B13R1.52 COc1cc(ccc1Br)CC(=O)C 1458a_200010002685_200000210301 [0,0,1,0,0,0|2,0,1]=4 397 B13R1.52 COc1cc(ccc1Br)CC(=O)[13CH3] 1458a_200010002685_200025704644 [0,0,1,0,0,0|2,0,1]=4 398 B13R1.52 COc1cc(ccc1Br)CN(C)C 2230a_100102631434_100010110085 [0,0,1,0,0,0|3,0,0]=4 399 B13R1.52 COc1cc(ccc1Br)CN(C)C 269982a_100102631434_100010110085 [0,0,1,0,0,0|3,0,0]=4 400 B13R1.52 COc1cc(ccc1Br)CN(C)C 270004a_100102631434_100010244714 [0,0,1,0,0,0|3,0,0]=4 401 B13R1.52 COc1cc(ccc1Br)NC(C)C 2230a_100000765947_100000210206 [0,0,1,0,0,0|3,0,0]=4 402 B13R1.52 COc1cc(ccc1Br)NC(C)C 34a_100000765947_100000210206 [0,0,1,0,0,0|3,0,0]=4 403 B13R1.52 COc1cc(ccc1Br)OC(C)C 34a_100011827694_100000210206 [0,0,1,0,0,0|3,0,0]=4 404 B13R1.52 COc1cc(ccc1Br)OC(C)C 7a_100011827694_100000210206 [0,0,1,0,0,0|3,0,0]=4 405 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100000210206_100012353699 [0,0,1,0,0,0|3,0,0]=4 406 B13R1.52 COc1cc(ccc1Br)SC(C)C 62a_100012353699_100000210206 [0,0,1,0,0,0|3,0,0]=4 407 B13R1.52 COc1cc(ccc1C)CN(C)C 270004a_100102631434_100000719150 [0,0,1,0,0,0|3,0,0]=4 408 B13R1.52 COc1cc(ccc1C)NC(C)C 2230a_100011279678_100000210206 [0,0,1,0,0,0|3,0,0]=4 409 B13R1.52 COc1cc(ccc1C)NC(C)C 34a_100011279678_100000210206 [0,0,1,0,0,0|3,0,0]=4 410 B13R1.52 COc1cc(ccc1C)OC(C)C 34a_100009865632_100000210206 [0,0,1,0,0,0|3,0,0]=4 411 B13R1.52 COc1cc(ccc1C)OC(C)C 7a_100009865632_100000210206 [0,0,1,0,0,0|3,0,0]=4 412 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100000210206_100011830276 [0,0,1,0,0,0|3,0,0]=4 413 B13R1.52 COc1cc(ccc1C)SC(C)C 62a_100011830276_100000210206 [0,0,1,0,0,0|3,0,0]=4 414 B13R1.52 COc1cc(ccc1Cl)CC(=O)C 1458a_100000070787_200010214485 [0,0,1,0,0,0|2,0,1]=4 415 B13R1.52 COc1cc(ccc1Cl)CN(C)C 2230a_100102631434_200010214485 [0,0,1,0,0,0|3,0,0]=4 416 B13R1.52 COc1cc(ccc1Cl)CN(C)C 269982a_100102631434_200010214485 [0,0,1,0,0,0|3,0,0]=4 417 B13R1.52 COc1cc(ccc1Cl)CN(C)C 270004a_100102631434_100011998524 [0,0,1,0,0,0|3,0,0]=4 418 B13R1.52 COc1cc(ccc1Cl)NC(C)C 2230a_100000742311_100000210206 [0,0,1,0,0,0|3,0,0]=4 419 B13R1.52 COc1cc(ccc1Cl)NC(C)C 34a_100000742311_100000210206 [0,0,1,0,0,0|3,0,0]=4 420 B13R1.52 COc1cc(ccc1Cl)OC(C)C 34a_100012186310_100000210206 [0,0,1,0,0,0|3,0,0]=4 421 B13R1.52 COc1cc(ccc1Cl)OC(C)C 7a_100012186310_100000210206 [0,0,1,0,0,0|3,0,0]=4 422 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100000210206_100011356853 [0,0,1,0,0,0|3,0,0]=4 423 B13R1.52 COc1cc(ccc1Cl)SC(C)C 62a_100011356853_100000210206 [0,0,1,0,0,0|3,0,0]=4 424 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000070787_100012349856 [0,0,1,0,0,0|2,0,1]=4 425 B13R1.52 COc1cc(ccc1F)CC(=O)C 1458a_100000117344_200000210301 [0,0,1,0,0,0|2,0,1]=4 426 B13R1.52 COc1cc(ccc1F)CC(=O)[13CH3] 1458a_100000117344_200025704644 [0,0,1,0,0,0|2,0,1]=4 427 B13R1.52 COc1cc(ccc1F)CN(C)C 2230a_100102631434_100012349856 [0,0,1,0,0,0|3,0,0]=4 428 B13R1.52 COc1cc(ccc1F)CN(C)C 269982a_100102631434_100012349856 [0,0,1,0,0,0|3,0,0]=4 429 B13R1.52 COc1cc(ccc1F)CN(C)C 270004a_100102631434_100000692873 [0,0,1,0,0,0|3,0,0]=4 430 B13R1.52 COc1cc(ccc1F)NC(C)C 2230a_100000701188_100000210206 [0,0,1,0,0,0|3,0,0]=4 431 B13R1.52 COc1cc(ccc1F)NC(C)C 34a_100000701188_100000210206 [0,0,1,0,0,0|3,0,0]=4 432 B13R1.52 COc1cc(ccc1F)OC(C)C 34a_100012001760_100000210206 [0,0,1,0,0,0|3,0,0]=4 433 B13R1.52 COc1cc(ccc1F)OC(C)C 7a_100012001760_100000210206 [0,0,1,0,0,0|3,0,0]=4 434 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100000210206_100011934186 [0,0,1,0,0,0|3,0,0]=4 435 B13R1.52 COc1cc(ccc1F)SC(C)C 62a_100011934186_100000210206 [0,0,1,0,0,0|3,0,0]=4 436 B13R1.52 COc1cc(ccc1I)NC(C)C 34a_100000746945_100000210206 [0,0,1,0,0,0|3,0,0]=4 437 B13R1.52 COc1cc(ccc1N)OC(C)C 34a_100015326901_100000210206 [0,0,1,0,0,0|3,0,0]=4 438 B13R1.52 COc1cc(ccc1N)OC(C)C 7a_100015326901_100000210206 [0,0,1,0,0,0|3,0,0]=4 439 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100000210206_100015196925 [0,0,1,0,0,0|3,0,0]=4 440 B13R1.52 COc1cc(ccc1N)SC(C)C 62a_100011279103_100000210206 [0,0,1,0,0,0|3,0,0]=4 441 B13R1.52 COc1cc(ccc1O)C=C(C)C 271570a_100102525489_100000694246 [0,0,1,0,0,0|1,0,2]=4 442 B13R1.52 COc1cc(ccc1O)CC(=O)C 1458a_100000032101_200000210301 [0,0,1,0,0,0|1,0,1]=3 443 B13R1.52 COc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000032101_200025704644 [0,0,1,0,0,0|1,0,1]=3 444 B13R1.52 COc1cc(ccc1O)NC(=O)C 22a_100000726020_100000070787 [0,0,1,0,0,0|2,0,1]=4 445 B13R1.52 COc1cc(ccc1O)NC(=O)C 527a_100000726020_100103153847 [0,0,1,0,0,0|2,0,1]=4 446 B13R1.52 COc1cc(ccc1O)NC(C)C 34a_100000726020_100000210206 [0,0,1,0,0,0|2,0,0]=3 447 B13R1.52 COc1cc(ccc1O)SC(C)C 62a_100000210206_100000694246 [0,0,1,0,0,0|2,0,0]=3 448 B13R1.52 COc1nc(ccc1O)SC(C)C 62a_100000210206_100010893133 [0,0,1,0,0,0|3,0,0]=4 449 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_100010141077_200000210301 [0,0,1,0,0,0|1,1,1]=4 450 B13R1.52 CSc1cc(ccc1O)CC(=O)C 62a_200000210301_100010141077 [0,0,1,0,0,0|1,1,1]=4 451 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 34a_100011218180_100015361967 [0,0,1,0,0,0|2,0,1]=4 452 B13R1.142 CC(=O)Cc1ccc(cc1)OCF 7a_100011218180_100015361967 [0,0,1,0,0,0|2,0,1]=4 453 B13R1.142 CC(C)Cc1ccc(cc1)NCF 34a_100000687309_100015361967 [0,0,1,0,0,0|3,0,0]=4 454 B13R1.142 CC(C)Cc1ccc(cc1)SCF 62a_100011221366_100015361967 [0,0,1,0,0,0|2,1,0]=4 455 B13R1.142 CC(C)Cc1ccc(cc1)SCF 62a_100015361967_100011221366 [0,0,1,0,0,0|2,1,0]=4 456 B13R1.142 CC(C)Nc1ccc(cc1)CCO 2230a_100011204434_100000210206 [0,0,1,0,0,0|3,0,0]=4 457 B13R1.142 CC(C)Nc1ccc(cc1)CCO 34a_100011204434_100000210206 [0,0,1,0,0,0|3,0,0]=4 458 B13R1.142 CC(C)Oc1ccc(cc1)CCO 34a_100011215338_100000210206 [0,0,1,0,0,0|3,0,0]=4 459 B13R1.142 CC(C)Oc1ccc(cc1)CCO 7a_100011215338_100000210206 [0,0,1,0,0,0|3,0,0]=4 460 B13R1.142 CC(C)Oc1ccc(cc1)OCF 34a_100000757185_100015361967 [0,0,1,0,0,0|3,0,0]=4 461 B13R1.142 CC(C)Oc1ccc(cc1)OCF 7a_100000757185_100015361967 [0,0,1,0,0,0|3,0,0]=4 462 B13R1.142 CC(C)Sc1ccc(cc1)CCO 62a_100000210206_100000766406 [0,0,1,0,0,0|3,0,0]=4 463 B13R1.142 CC(C)Sc1ccc(cc1)CCO 62a_100000766406_100000210206 [0,0,1,0,0,0|3,0,0]=4 464 B13R1.142 CC(N)Cc1ccc(cc1)OCF 34a_100102634573_100015361967 [0,0,1,0,0,0|1,0,0]=2 465 B13R1.142 CCNc1ccc(cc1)CC(C)C 2230a_100000687309_100000210202 [0,0,1,0,0,0|3,0,0]=4 466 B13R1.142 CCNc1ccc(cc1)CC(C)C 34a_100000687309_100000210202 [0,0,1,0,0,0|3,0,0]=4 467 B13R1.142 CCOc1ccc(cc1)CC(=O)C 1458a_100000183096_200000210301 [0,0,1,0,0,0|2,0,1]=4 468 B13R1.142 CCOc1ccc(cc1)CC(=O)C 34a_100011218180_100000210202 [0,0,1,0,0,0|2,0,1]=4 469 B13R1.142 CCOc1ccc(cc1)CC(=O)C 7a_100011218180_100000210202 [0,0,1,0,0,0|2,0,1]=4 470 B13R1.142 CCOc1ccc(cc1)CC(=O)N 34a_100000020825_100000210202 [0,0,1,0,0,0|2,0,1]=4 471 B13R1.142 CCOc1ccc(cc1)CC(=O)[13CH3] 1458a_100000183096_200025704644 [0,0,1,0,0,0|2,0,1]=4 472 B13R1.142 CCOc1ccc(cc1)CC(C)N 34a_100102634573_100000210202 [0,0,1,0,0,0|1,0,0]=2 473 B13R1.142 CCOc1ccc(cc1)CN(C)C 2230a_100000180828_200000210301 [0,0,1,0,0,0|3,0,0]=4 474 B13R1.142 CCOc1ccc(cc1)CN(C)C 269982a_100000180828_200000210301 [0,0,1,0,0,0|3,0,0]=4 475 B13R1.142 CCOc1ccc(cc1)CN(C)C 270004a_100102631434_100000169836 [0,0,1,0,0,0|3,0,0]=4 476 B13R1.142 CCOc1ccc(cc1)CN(C)[13CH3] 2230a_100000180828_200025704644 [0,0,1,0,0,0|3,0,0]=4 477 B13R1.142 CCOc1ccc(cc1)CN(C)[13CH3] 269982a_100000180828_200025704644 [0,0,1,0,0,0|3,0,0]=4 478 B13R1.142 CCOc1ccc(cc1)NC(C)C 2230a_100000739623_100000210206 [0,0,1,0,0,0|3,0,0]=4 479 B13R1.142 CCOc1ccc(cc1)NC(C)C 34a_100000739623_100000210206 [0,0,1,0,0,0|3,0,0]=4 480 B13R1.142 CCOc1ccc(cc1)OC(C)C 34a_100000185467_100000210206 [0,0,1,0,0,0|3,0,0]=4 481 B13R1.142 CCOc1ccc(cc1)OC(C)C 34a_100000757185_100000210202 [0,0,1,0,0,0|3,0,0]=4 482 B13R1.142 CCOc1ccc(cc1)OC(C)C 7a_100000757185_100000210202 [0,0,1,0,0,0|3,0,0]=4 483 B13R1.142 CCOc1ccc(cc1)SC(C)C 62a_100000210206_100000171712 [0,0,1,0,0,0|3,0,0]=4 484 B13R1.142 CCSc1ccc(cc1)CC(C)C 62a_100000210202_100011221366 [0,0,1,0,0,0|2,1,0]=4 485 B13R1.142 CCSc1ccc(cc1)CC(C)C 62a_100011221366_100000210202 [0,0,1,0,0,0|2,1,0]=4 486 B13R1.142 CNCc1ccc(cc1)CC(C)N 26a_100102657272_100102634573 [0,0,1,0,0,0|3,0,0]=4 487 B13R1.142 NC(=O)Cc1ccc(cc1)OCF 34a_100000020825_100015361967 [0,0,1,0,0,0|2,0,1]=4 488 B13R1.373 CC(C)Cc1cccc(c1)SCF 62a_100010883412_100015361967 [0,0,1,0,0,0|2,1,0]=4 489 B13R1.373 CC(C)Cc1cccc(c1)SCF 62a_100015361967_100010883412 [0,0,1,0,0,0|2,1,0]=4 490 B13R1.373 CC(C)Nc1cccc(c1)CCO 2230a_100011996697_100000210206 [0,0,1,0,0,0|3,0,0]=4 491 B13R1.373 CC(C)Nc1cccc(c1)CCO 34a_100011996697_100000210206 [0,0,1,0,0,0|3,0,0]=4 492 B13R1.373 CC(C)Oc1cccc(c1)CCO 34a_100011215281_100000210206 [0,0,1,0,0,0|3,0,0]=4 493 B13R1.373 CC(C)Oc1cccc(c1)CCO 7a_100011215281_100000210206 [0,0,1,0,0,0|3,0,0]=4 494 B13R1.373 CC(C)Oc1cccc(c1)OCF 34a_100000753242_100015361967 [0,0,1,0,0,0|3,0,0]=4 495 B13R1.373 CC(C)Oc1cccc(c1)OCF 7a_100000753242_100015361967 [0,0,1,0,0,0|3,0,0]=4 496 B13R1.373 CC(C)Sc1cccc(c1)CCO 62a_100000210206_100011217444 [0,0,1,0,0,0|3,0,0]=4 497 B13R1.373 CC(C)Sc1cccc(c1)CCO 62a_100011217444_100000210206 [0,0,1,0,0,0|3,0,0]=4 498 B13R1.373 CCOc1cccc(c1)CC(=O)C 1458a_100000690747_200000210301 [0,0,1,0,0,0|2,0,1]=4 499 B13R1.373 CCOc1cccc(c1)CC(=O)N 34a_200000747573_100000210202 [0,0,1,0,0,0|2,0,1]=4 500 B13R1.373 CCOc1cccc(c1)CC(=O)N 7a_200000747573_100000210202 [0,0,1,0,0,0|2,0,1]=4 501 B13R1.373 CCOc1cccc(c1)CC(=O)[13CH3] 1458a_100000690747_200025704644 [0,0,1,0,0,0|2,0,1]=4 502 B13R1.373 CCOc1cccc(c1)CN(C)C 270004a_100102631434_100000170239 [0,0,1,0,0,0|3,0,0]=4 503 B13R1.373 CCOc1cccc(c1)NC(C)C 2230a_100000742568_100000210206 [0,0,1,0,0,0|3,0,0]=4 504 B13R1.373 CCOc1cccc(c1)NC(C)C 34a_100000742568_100000210206 [0,0,1,0,0,0|3,0,0]=4 505 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100000753242_100000210202 [0,0,1,0,0,0|3,0,0]=4 506 B13R1.373 CCOc1cccc(c1)OC(C)C 34a_100011215941_100000210206 [0,0,1,0,0,0|3,0,0]=4 507 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100000753242_100000210202 [0,0,1,0,0,0|3,0,0]=4 508 B13R1.373 CCOc1cccc(c1)OC(C)C 7a_100011215941_100000210206 [0,0,1,0,0,0|3,0,0]=4 509 B13R1.373 CCOc1cccc(c1)SC(C)C 62a_100000210206_100000170002 [0,0,1,0,0,0|3,0,0]=4 510 B13R1.373 CCSc1cccc(c1)CC(C)C 62a_100000210202_100010883412 [0,0,1,0,0,0|2,1,0]=4 511 B13R1.373 CCSc1cccc(c1)CC(C)C 62a_100010883412_100000210202 [0,0,1,0,0,0|2,1,0]=4 512 B13R1.373 NC(=O)Cc1cccc(c1)OCF 34a_200000747573_100015361967 [0,0,1,0,0,0|2,0,1]=4 513 B13R1.373 NC(=O)Cc1cccc(c1)OCF 7a_200000747573_100015361967 [0,0,1,0,0,0|2,0,1]=4 514 B15R3.4379 c1cc2c(cc1NC3CC3)CCO2 34a_100000736984_100000211595 [0,0,0,1,0,0|3,0,0]=4 515 B15R3.4379 c1cc2c(cc1NC3CC3)OCO2 34a_100000209953_100000211595 [0,0,0,1,0,0|2,0,0]=3 516 B15R3.4379 c1cc2c(cc1OC3CC3)OCO2 34a_100000210298_100000211595 [0,0,0,1,0,0|2,0,0]=3 517 B15R3.4379 c1cc2c(cc1SC3CC3)CCO2 62a_100000729065_100000211595 [0,0,0,1,0,0|3,0,0]=4 518 B15R3.4379 c1cc2c(cc1SC3CC3)OCC2 62a_100009818566_100000211595 [0,0,0,1,0,0|3,0,0]=4 519 B13R2.430 C=C(C)c1ccc2c(c1)CCO2 271570a_100000694244_100000729065 [0,0,0,0,1,0|2,0,1]=4 520 B13R2.430 C=C(C)c1ccc2c(c1)OCC2 271570a_100000694244_100009818566 [0,0,0,0,1,0|2,0,1]=4 521 B13R2.430 C=C(C)c1ccc2c(c1)OCO2 271570a_100000694244_100000688060 [0,0,0,0,1,0|1,0,1]=3 522 B13R2.430 CC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200000210301 [0,0,0,0,1,0|2,0,1]=4 523 B13R2.430 CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000210301 [0,0,0,0,1,0|1,0,1]=3 524 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)CCO2 1458a_100011207309_200025704644 [0,0,0,0,1,0|2,0,1]=4 525 B13R2.430 [13CH3]C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200025704644 [0,0,0,0,1,0|1,0,1]=3 526 B13R2.1279 CC(C)Sc1ccc2c(c1)CC2 62a_100000210206_100009818592 [0,0,0,0,1,0|3,0,0]=4 527 B13R2.1279 CC(C)Sc1ccc2c(c1)CC2 62a_100009818592_100000210206 [0,0,0,0,1,0|3,0,0]=4 528 B13R2.1279 CN(C)Cc1ccc2c(c1)CC2 270004a_100102631434_100010273998 [0,0,0,0,1,0|3,0,0]=4 529 B15R2.1668 CC(=Cc1ccc2c(c1)OCCO2)C 271570a_100102525489_100000184379 [0,0,0,0,0,1|1,0,2]=4 530 B15R2.1668 CC(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200000210301 [0,0,0,0,0,1|1,0,1]=3 531 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 11a_100020630400_100015343762 [0,0,0,0,0,1|2,0,1]=4 532 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 1626a_100020630400_100015343762 [0,0,0,0,0,1|2,0,1]=4 533 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 22a_100020630400_100000070787 [0,0,0,0,0,1|2,0,1]=4 534 B15R2.1668 CC(=O)Nc1ccc2c(c1)OCCO2 527a_100020630400_100103153847 [0,0,0,0,0,1|2,0,1]=4 535 B15R2.1668 CC(C)Nc1ccc2c(c1)CCCO2 2230a_100138412508_100000210206 [0,0,0,0,0,1|3,0,0]=4 536 B15R2.1668 CC(C)Nc1ccc2c(c1)CCCO2 34a_100138412508_100000210206 [0,0,0,0,0,1|3,0,0]=4 537 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000210206 [0,0,0,0,0,1|2,0,0]=3 538 B15R2.1668 CC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100000210206 [0,0,0,0,0,1|2,0,0]=3 539 B15R2.1668 CC(C)Oc1ccc2c(c1)CCOC2 34a_100009841951_100000210206 [0,0,0,0,0,1|3,0,0]=4 540 B15R2.1668 CC(C)Oc1ccc2c(c1)CCOC2 7a_100009841951_100000210206 [0,0,0,0,0,1|3,0,0]=4 541 B15R2.1668 CC(C)Oc1ccc2c(c1)NCCO2 34a_100020636358_100000210206 [0,0,0,0,0,1|3,0,0]=4 542 B15R2.1668 CC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100000210206 [0,0,0,0,0,1|2,0,0]=3 543 B15R2.1668 CC(C)Sc1ccc2c(c1)CCCO2 62a_100000210206_100011393166 [0,0,0,0,0,1|3,0,0]=4 544 B15R2.1668 CC(C)Sc1ccc2c(c1)CCCO2 62a_100011393166_100000210206 [0,0,0,0,0,1|3,0,0]=4 545 B15R2.1668 CC(C)Sc1ccc2c(c1)COCC2 62a_100000210206_100010128096 [0,0,0,0,0,1|3,0,0]=4 546 B15R2.1668 CC(C)Sc1ccc2c(c1)COCC2 62a_100010128096_100000210206 [0,0,0,0,0,1|3,0,0]=4 547 B15R2.1668 CC(C)Sc1ccc2c(c1)NCCO2 62a_100000210206_100000708519 [0,0,0,0,0,1|3,0,0]=4 548 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCC2 62a_100000210206_100010700467 [0,0,0,0,0,1|3,0,0]=4 549 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCC2 62a_100010700467_100000210206 [0,0,0,0,0,1|3,0,0]=4 550 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCN2 62a_100000210206_100012355470 [0,0,0,0,0,1|3,0,0]=4 551 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100000210206_100011216881 [0,0,0,0,0,1|2,0,0]=3 552 B15R2.1668 CC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000210206 [0,0,0,0,0,1|2,0,0]=3 553 B15R2.1668 CN(C)Cc1ccc2c(c1)CCCO2 270004a_100102631434_100011934692 [0,0,0,0,0,1|3,0,0]=4 554 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_200000210301 [0,0,0,0,0,1|2,0,0]=3 555 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_200000210301 [0,0,0,0,0,1|2,0,0]=3 556 B15R2.1668 CN(C)Cc1ccc2c(c1)OCCO2 270004a_100102631434_100000184955 [0,0,0,0,0,1|2,0,0]=3 557 B15R2.1668 CN(C)Cc1ccc2c(n1)OCCO2 270004a_100102631434_100009856165 [0,0,0,0,0,1|3,0,0]=4 558 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 2230a_100000684720_200025704644 [0,0,0,0,0,1|2,0,0]=3 559 B15R2.1668 CN([13CH3])Cc1ccc2c(c1)OCCO2 269982a_100000684720_200025704644 [0,0,0,0,0,1|2,0,0]=3 560 B15R2.1668 [13CH3]C(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_200025704644 [0,0,0,0,0,1|1,0,1]=3 561 B15R2.7688 C=C(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000748629 [0,0,0,0,0,1|2,0,1]=4 562 B15R2.7688 C=C(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000748629 [0,0,0,0,0,1|2,0,1]=4 563 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748629 [0,0,0,0,0,1|1,0,1]=3 564 B15R2.7688 C=C(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748629 [0,0,0,0,0,1|1,0,1]=3 565 B15R2.7688 C=C(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748629 [0,0,0,0,0,1|1,0,1]=3 566 B15R2.7688 C=C(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000211660 [0,0,0,0,0,1|2,0,1]=4 567 B15R2.7688 C=C(C)CSc1ccc2c(c1)CCO2 62a_100000748629_100000729065 [0,0,0,0,0,1|2,0,1]=4 568 B15R2.7688 C=C(C)CSc1ccc2c(c1)OCC2 62a_100000748629_100009818566 [0,0,0,0,0,1|2,0,1]=4 569 B15R2.7688 C=C(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000211660 [0,0,0,0,0,1|2,0,1]=4 570 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009893438 [0,0,0,0,0,1|1,0,2]=4 571 B15R2.7688 C=C(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100009893438 [0,0,0,0,0,1|1,0,2]=4 572 B15R2.7688 C=C(F)COc1ccc2c(c1)OCO2 34a_100000210298_100009893438 [0,0,0,0,0,1|1,0,2]=4 573 B15R2.7688 CC(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200000210301 [0,0,0,0,0,1|1,0,2]=4 574 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000070787_100000763274 [0,0,0,0,0,1|2,0,1]=4 575 B15R2.7688 CC(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200000210301 [0,0,0,0,0,1|2,0,1]=4 576 B15R2.7688 CC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200000210301 [0,0,0,0,0,1|1,0,1]=3 577 B15R2.7688 CC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200000210301 [0,0,0,0,0,1|1,0,1]=3 578 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 11a_100011219410_100015343762 [0,0,0,0,0,1|2,0,1]=4 579 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 1626a_100011219410_100015343762 [0,0,0,0,0,1|2,0,1]=4 580 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 240690a_100011219410_100015343762 [0,0,0,0,0,1|2,0,1]=4 581 B15R2.7688 CC(=O)NCc1ccc2c(c1)CCO2 527a_100011219410_100103153847 [0,0,0,0,0,1|2,0,1]=4 582 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100015343762 [0,0,0,0,0,1|1,0,1]=3 583 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100015343762 [0,0,0,0,0,1|1,0,1]=3 584 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100015343762 [0,0,0,0,0,1|1,0,1]=3 585 B15R2.7688 CC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100103153847 [0,0,0,0,0,1|1,0,1]=3 586 B15R2.7688 CC(C)C=Cc1ccc2c(c1)CCO2 271570a_100016257149_100000729065 [0,0,0,0,0,1|2,0,1]=4 587 B15R2.7688 CC(C)C=Cc1ccc2c(c1)OCC2 271570a_100016257149_100009818566 [0,0,0,0,0,1|2,0,1]=4 588 B15R2.7688 CC(C)C=Cc1ccc2c(c1)OCO2 271570a_100016257149_100000688060 [0,0,0,0,0,1|1,0,1]=3 589 B15R2.7688 CC(C)CNc1ccc2c(c1)CCC2 2230a_100000211504_100000210760 [0,0,0,0,0,1|3,0,0]=4 590 B15R2.7688 CC(C)CNc1ccc2c(c1)CCC2 34a_100000211504_100000210624 [0,0,0,0,0,1|3,0,0]=4 591 B15R2.7688 CC(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000210760 [0,0,0,0,0,1|2,0,0]=3 592 B15R2.7688 CC(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000210624 [0,0,0,0,0,1|2,0,0]=3 593 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000210760 [0,0,0,0,0,1|1,0,0]=2 594 B15R2.7688 CC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000210624 [0,0,0,0,0,1|1,0,0]=2 595 B15R2.7688 CC(C)CNc1ccc2ccoc2c1 34a_100000102395_100000210624 [0,0,0,0,0,1|2,0,1]=4 596 B15R2.7688 CC(C)CNc1ccc2cnoc2c1 34a_100000084182_100000210624 [0,0,0,0,0,1|3,0,0]=4 597 B15R2.7688 CC(C)CNc1ccc2ncoc2c1 34a_100011248239_100000210624 [0,0,0,0,0,1|2,0,1]=4 598 B15R2.7688 CC(C)CNc1ccc2occc2c1 34a_106430523501_100000210624 [0,0,0,0,0,1|2,0,1]=4 599 B15R2.7688 CC(C)CNc1ccc2ocnc2c1 34a_100011219863_100000210624 [0,0,0,0,0,1|2,0,1]=4 600 B15R2.7688 CC(C)CNc1ccc2oncc2c1 34a_100000037595_100000210624 [0,0,0,0,0,1|3,0,0]=4 601 B15R2.7688 CC(C)COc1ccc2c(c1)CCC2 34a_100000209987_100000210624 [0,0,0,0,0,1|3,0,0]=4 602 B15R2.7688 CC(C)COc1ccc2c(c1)CCC2 7a_100000209987_100000210760 [0,0,0,0,0,1|3,0,0]=4 603 B15R2.7688 CC(C)COc1ccc2c(c1)CCN2 34a_100020636429_100000210624 [0,0,0,0,0,1|3,0,0]=4 604 B15R2.7688 CC(C)COc1ccc2c(c1)NCC2 34a_100020636427_100000210624 [0,0,0,0,0,1|3,0,0]=4 605 B15R2.7688 CC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000210624 [0,0,0,0,0,1|1,0,0]=2 606 B15R2.7688 CC(C)COc1ccc2ccoc2c1 34a_100000089557_100000210624 [0,0,0,0,0,1|2,0,1]=4 607 B15R2.7688 CC(C)COc1ccc2ccoc2c1 7a_100000089557_100000210760 [0,0,0,0,0,1|2,0,1]=4 608 B15R2.7688 CC(C)COc1ccc2cnoc2c1 34a_100000098417_100000210624 [0,0,0,0,0,1|3,0,0]=4 609 B15R2.7688 CC(C)COc1ccc2cnoc2c1 7a_100000098417_100000210760 [0,0,0,0,0,1|3,0,0]=4 610 B15R2.7688 CC(C)COc1ccc2occc2c1 34a_100000070125_100000210624 [0,0,0,0,0,1|2,0,1]=4 611 B15R2.7688 CC(C)COc1ccc2occc2c1 7a_100000070125_100000210760 [0,0,0,0,0,1|2,0,1]=4 612 B15R2.7688 CC(C)CSc1cc2c(cn1)OCC2 62a_100000210624_102495363667 [0,0,0,0,0,1|3,0,0]=4 613 B15R2.7688 CC(C)CSc1cc2c(cn1)OCC2 62a_102495363667_100000210760 [0,0,0,0,0,1|3,0,0]=4 614 B15R2.7688 CC(C)CSc1ccc2c(c1)CCC2 62a_100000210624_100000745594 [0,0,0,0,0,1|3,0,0]=4 615 B15R2.7688 CC(C)CSc1ccc2c(c1)CCC2 62a_100000745594_100000210760 [0,0,0,0,0,1|3,0,0]=4 616 B15R2.7688 CC(C)CSc1ccc2c(c1)CCN2 62a_100000210624_100000691068 [0,0,0,0,0,1|3,0,0]=4 617 B15R2.7688 CC(C)CSc1ccc2c(c1)CCN2 62a_100000691068_100000210760 [0,0,0,0,0,1|3,0,0]=4 618 B15R2.7688 CC(C)CSc1ccc2c(c1)CCO2 62a_100000210624_100000729065 [0,0,0,0,0,1|2,0,0]=3 619 B15R2.7688 CC(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000210760 [0,0,0,0,0,1|2,0,0]=3 620 B15R2.7688 CC(C)CSc1ccc2c(c1)NCC2 62a_100000210624_100000754641 [0,0,0,0,0,1|3,0,0]=4 621 B15R2.7688 CC(C)CSc1ccc2c(c1)NCC2 62a_100000754641_100000210760 [0,0,0,0,0,1|3,0,0]=4 622 B15R2.7688 CC(C)CSc1ccc2c(c1)OCC2 62a_100000210624_100009818566 [0,0,0,0,0,1|2,0,0]=3 623 B15R2.7688 CC(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000210760 [0,0,0,0,0,1|2,0,0]=3 624 B15R2.7688 CC(C)CSc1ccc2ccoc2c1 62a_100000210624_100000759542 [0,0,0,0,0,1|2,0,1]=4 625 B15R2.7688 CC(C)CSc1ccc2cnoc2c1 62a_100000210624_100009817722 [0,0,0,0,0,1|3,0,0]=4 626 B15R2.7688 CC(C)CSc1ccc2ncoc2c1 62a_100000210624_100009817590 [0,0,0,0,0,1|2,0,1]=4 627 B15R2.7688 CC(C)CSc1ccc2occc2c1 62a_100000210624_100000691453 [0,0,0,0,0,1|2,0,1]=4 628 B15R2.7688 CC(C)CSc1ccc2ocnc2c1 62a_100000210624_100009816175 [0,0,0,0,0,1|2,0,1]=4 629 B15R2.7688 CC(C)CSc1ccc2oncc2c1 62a_100000210624_100009817723 [0,0,0,0,0,1|3,0,0]=4 630 B15R2.7688 CC(C)NCc1ccc2c(c1)CCC2 207a_100138425928_100000765347 [0,0,0,0,0,1|3,0,0]=4 631 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 207a_100138425928_100011218456 [0,0,0,0,0,1|2,0,0]=3 632 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000210206 [0,0,0,0,0,1|2,0,0]=3 633 B15R2.7688 CC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_100000210206 [0,0,0,0,0,1|2,0,0]=3 634 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000210206 [0,0,0,0,0,1|1,0,0]=2 635 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000210206 [0,0,0,0,0,1|1,0,0]=2 636 B15R2.7688 CC(C)NCc1ccc2c(c1)OCO2 34a_100138425928_100000189651 [0,0,0,0,0,1|1,0,0]=2 637 B15R2.7688 CC(C)NCc1ccc2ncoc2c1 207a_100138425928_100000059852 [0,0,0,0,0,1|2,0,1]=4 638 B15R2.7688 CC(C)NCc1ccc2ncoc2c1 2230a_100138425928_106359897996 [0,0,0,0,0,1|2,0,1]=4 639 B15R2.7688 CC(C)NCc1ccc2ncoc2c1 34a_100138425928_106359897996 [0,0,0,0,0,1|2,0,1]=4 640 B15R2.7688 CC(C)NCc1ccc2occc2c1 207a_100138425928_100000040644 [0,0,0,0,0,1|2,0,1]=4 641 B15R2.7688 CC(C)NCc1ccc2occc2c1 2230a_100020591328_100000210206 [0,0,0,0,0,1|2,0,1]=4 642 B15R2.7688 CC(C)NCc1ccc2occc2c1 34a_100020591328_100000210206 [0,0,0,0,0,1|2,0,1]=4 643 B15R2.7688 CC(C)NCc1ccc2ocnc2c1 207a_100138425928_100010271902 [0,0,0,0,0,1|2,0,1]=4 644 B15R2.7688 CC(C)NCc1ccc2ocnc2c1 2230a_100138425928_200010203175 [0,0,0,0,0,1|2,0,1]=4 645 B15R2.7688 CC(C)NCc1ccc2ocnc2c1 34a_100138425928_200010203175 [0,0,0,0,0,1|2,0,1]=4 646 B15R2.7688 CC(C)OCc1ccc2c(c1)CCC2 34a_200000765175_100000210206 [0,0,0,0,0,1|3,0,0]=4 647 B15R2.7688 CC(C)OCc1ccc2c(c1)CCC2 7a_200000765175_100000210206 [0,0,0,0,0,1|3,0,0]=4 648 B15R2.7688 CC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_100000210206 [0,0,0,0,0,1|2,0,0]=3 649 B15R2.7688 CC(C)OCc1ccc2c(c1)CCO2 7a_100011219353_100000210206 [0,0,0,0,0,1|2,0,0]=3 650 B15R2.7688 CC(C)OCc1ccc2c(c1)NCC2 34a_100000694088_100000210206 [0,0,0,0,0,1|3,0,0]=4 651 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000210206 [0,0,0,0,0,1|1,0,0]=2 652 B15R2.7688 CC(C)OCc1ccc2c(c1)OCO2 34a_100000212225_100000189651 [0,0,0,0,0,1|1,0,0]=2 653 B15R2.7688 CC(C)OCc1ccc2ccoc2c1 34a_200009859634_100000210206 [0,0,0,0,0,1|2,0,1]=4 654 B15R2.7688 CC(C)OCc1ccc2ccoc2c1 7a_200009859634_100000210206 [0,0,0,0,0,1|2,0,1]=4 655 B15R2.7688 CC(C)OCc1ccc2ncoc2c1 34a_100000212225_106359897996 [0,0,0,0,0,1|2,0,1]=4 656 B15R2.7688 CC(C)OCc1ccc2occc2c1 34a_100000067418_100000210206 [0,0,0,0,0,1|2,0,1]=4 657 B15R2.7688 CC(C)OCc1ccc2occc2c1 7a_100000067418_100000210206 [0,0,0,0,0,1|2,0,1]=4 658 B15R2.7688 CC(C)OCc1ccc2ocnc2c1 34a_100000212225_200010203175 [0,0,0,0,0,1|2,0,1]=4 659 B15R2.7688 CC(C)SCc1ccc2ncoc2c1 62a_100000210206_106359897996 [0,0,0,0,0,1|2,0,1]=4 660 B15R2.7688 CC(C)SCc1ccc2ncoc2c1 62a_106359897996_100000210206 [0,0,0,0,0,1|2,0,1]=4 661 B15R2.7688 CC(C)SCc1ccc2ocnc2c1 62a_100000210206_200010203175 [0,0,0,0,0,1|2,0,1]=4 662 B15R2.7688 CC(O)C=Cc1ccc2c(c1)CCO2 271570a_200011019289_100000729065 [0,0,0,0,0,1|2,0,1]=4 663 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCC2 271570a_200011019289_100009818566 [0,0,0,0,0,1|2,0,1]=4 664 B15R2.7688 CC(O)C=Cc1ccc2c(c1)OCO2 271570a_200011019289_100000688060 [0,0,0,0,0,1|1,0,1]=3 665 B15R2.7688 CC(O)CNc1ccc2c(c1)CCC2 2230a_100000211504_100011218427 [0,0,0,0,0,1|3,0,0]=4 666 B15R2.7688 CC(O)CNc1ccc2c(c1)CCC2 34a_100000211504_100011218427 [0,0,0,0,0,1|3,0,0]=4 667 B15R2.7688 CC(O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100011218427 [0,0,0,0,0,1|2,0,0]=3 668 B15R2.7688 CC(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100011218427 [0,0,0,0,0,1|2,0,0]=3 669 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011218427 [0,0,0,0,0,1|1,0,0]=2 670 B15R2.7688 CC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011218427 [0,0,0,0,0,1|1,0,0]=2 671 B15R2.7688 CC(O)CNc1ccc2ccoc2c1 34a_100000102395_100011218427 [0,0,0,0,0,1|2,0,1]=4 672 B15R2.7688 CC(O)CNc1ccc2cnoc2c1 34a_100000084182_100011218427 [0,0,0,0,0,1|3,0,0]=4 673 B15R2.7688 CC(O)CNc1ccc2ncoc2c1 34a_100011248239_100011218427 [0,0,0,0,0,1|2,0,1]=4 674 B15R2.7688 CC(O)CNc1ccc2occc2c1 34a_106430523501_100011218427 [0,0,0,0,0,1|2,0,1]=4 675 B15R2.7688 CC(O)CNc1ccc2ocnc2c1 34a_100011219863_100011218427 [0,0,0,0,0,1|2,0,1]=4 676 B15R2.7688 CC(O)CNc1ccc2oncc2c1 34a_100000037595_100011218427 [0,0,0,0,0,1|3,0,0]=4 677 B15R2.7688 CC(O)COc1ccc2c(c1)CCC2 34a_100000209987_100011218427 [0,0,0,0,0,1|3,0,0]=4 678 B15R2.7688 CC(O)COc1ccc2c(c1)CCC2 7a_100000209987_100011218427 [0,0,0,0,0,1|3,0,0]=4 679 B15R2.7688 CC(O)COc1ccc2c(c1)CCN2 34a_100020636429_100011218427 [0,0,0,0,0,1|3,0,0]=4 680 B15R2.7688 CC(O)COc1ccc2c(c1)NCC2 34a_100020636427_100011218427 [0,0,0,0,0,1|3,0,0]=4 681 B15R2.7688 CC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011218427 [0,0,0,0,0,1|1,0,0]=2 682 B15R2.7688 CC(O)COc1ccc2ccoc2c1 34a_100000089557_100011218427 [0,0,0,0,0,1|2,0,1]=4 683 B15R2.7688 CC(O)COc1ccc2ccoc2c1 7a_100000089557_100011218427 [0,0,0,0,0,1|2,0,1]=4 684 B15R2.7688 CC(O)COc1ccc2cnoc2c1 34a_100000098417_100011218427 [0,0,0,0,0,1|3,0,0]=4 685 B15R2.7688 CC(O)COc1ccc2cnoc2c1 7a_100000098417_100011218427 [0,0,0,0,0,1|3,0,0]=4 686 B15R2.7688 CC(O)COc1ccc2occc2c1 34a_100000070125_100011218427 [0,0,0,0,0,1|2,0,1]=4 687 B15R2.7688 CC(O)COc1ccc2occc2c1 7a_100000070125_100011218427 [0,0,0,0,0,1|2,0,1]=4 688 B15R2.7688 CC(O)CSc1cc2c(cn1)OCC2 62a_100011218427_102495363667 [0,0,0,0,0,1|3,0,0]=4 689 B15R2.7688 CC(O)CSc1cc2c(cn1)OCC2 62a_102495363667_100011218427 [0,0,0,0,0,1|3,0,0]=4 690 B15R2.7688 CC(O)CSc1ccc2c(c1)CCC2 62a_100000745594_100011218427 [0,0,0,0,0,1|3,0,0]=4 691 B15R2.7688 CC(O)CSc1ccc2c(c1)CCC2 62a_100011218427_100000745594 [0,0,0,0,0,1|3,0,0]=4 692 B15R2.7688 CC(O)CSc1ccc2c(c1)CCN2 62a_100000691068_100011218427 [0,0,0,0,0,1|3,0,0]=4 693 B15R2.7688 CC(O)CSc1ccc2c(c1)CCN2 62a_100011218427_100000691068 [0,0,0,0,0,1|3,0,0]=4 694 B15R2.7688 CC(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100011218427 [0,0,0,0,0,1|2,0,0]=3 695 B15R2.7688 CC(O)CSc1ccc2c(c1)CCO2 62a_100011218427_100000729065 [0,0,0,0,0,1|2,0,0]=3 696 B15R2.7688 CC(O)CSc1ccc2c(c1)NCC2 62a_100000754641_100011218427 [0,0,0,0,0,1|3,0,0]=4 697 B15R2.7688 CC(O)CSc1ccc2c(c1)NCC2 62a_100011218427_100000754641 [0,0,0,0,0,1|3,0,0]=4 698 B15R2.7688 CC(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100011218427 [0,0,0,0,0,1|2,0,0]=3 699 B15R2.7688 CC(O)CSc1ccc2c(c1)OCC2 62a_100011218427_100009818566 [0,0,0,0,0,1|2,0,0]=3 700 B15R2.7688 CC(O)CSc1ccc2ccoc2c1 62a_100011218427_100000759542 [0,0,0,0,0,1|2,0,1]=4 701 B15R2.7688 CC(O)CSc1ccc2cnoc2c1 62a_100011218427_100009817722 [0,0,0,0,0,1|3,0,0]=4 702 B15R2.7688 CC(O)CSc1ccc2ncoc2c1 62a_100011218427_100009817590 [0,0,0,0,0,1|2,0,1]=4 703 B15R2.7688 CC(O)CSc1ccc2occc2c1 62a_100011218427_100000691453 [0,0,0,0,0,1|2,0,1]=4 704 B15R2.7688 CC(O)CSc1ccc2ocnc2c1 62a_100011218427_100009816175 [0,0,0,0,0,1|2,0,1]=4 705 B15R2.7688 CC(O)CSc1ccc2oncc2c1 62a_100011218427_100009817723 [0,0,0,0,0,1|3,0,0]=4 706 B15R2.7688 CN(C)CCc1ccc2c(c1)CCO2 2230a_100102631434_100000763274 [0,0,0,0,0,1|3,0,0]=4 707 B15R2.7688 CN(C)CCc1ccc2c(c1)CCO2 269982a_100102631434_100000763274 [0,0,0,0,0,1|3,0,0]=4 708 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCC2 2230a_100000211504_100009817552 [0,0,0,0,0,1|3,0,0]=4 709 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCC2 34a_100000211504_100009817552 [0,0,0,0,0,1|3,0,0]=4 710 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100009817552 [0,0,0,0,0,1|2,0,0]=3 711 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)CCO2 34a_100000736984_100009817552 [0,0,0,0,0,1|2,0,0]=3 712 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009817552 [0,0,0,0,0,1|1,0,0]=2 713 B15R2.7688 C[C@@H](O)CNc1ccc2c(c1)OCO2 34a_100000209953_100009817552 [0,0,0,0,0,1|1,0,0]=2 714 B15R2.7688 C[C@@H](O)CNc1ccc2ccoc2c1 34a_100000102395_100009817552 [0,0,0,0,0,1|2,0,1]=4 715 B15R2.7688 C[C@@H](O)CNc1ccc2cnoc2c1 34a_100000084182_100009817552 [0,0,0,0,0,1|3,0,0]=4 716 B15R2.7688 C[C@@H](O)CNc1ccc2ncoc2c1 34a_100011248239_100009817552 [0,0,0,0,0,1|2,0,1]=4 717 B15R2.7688 C[C@@H](O)CNc1ccc2occc2c1 34a_106430523501_100009817552 [0,0,0,0,0,1|2,0,1]=4 718 B15R2.7688 C[C@@H](O)CNc1ccc2ocnc2c1 34a_100011219863_100009817552 [0,0,0,0,0,1|2,0,1]=4 719 B15R2.7688 C[C@@H](O)CNc1ccc2oncc2c1 34a_100000037595_100009817552 [0,0,0,0,0,1|3,0,0]=4 720 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)CCC2 34a_100000209987_100009817552 [0,0,0,0,0,1|3,0,0]=4 721 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)CCC2 7a_100000209987_100009817552 [0,0,0,0,0,1|3,0,0]=4 722 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)CCN2 34a_100020636429_100009817552 [0,0,0,0,0,1|3,0,0]=4 723 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)NCC2 34a_100020636427_100009817552 [0,0,0,0,0,1|3,0,0]=4 724 B15R2.7688 C[C@@H](O)COc1ccc2c(c1)OCO2 34a_100000210298_100009817552 [0,0,0,0,0,1|1,0,0]=2 725 B15R2.7688 C[C@@H](O)COc1ccc2ccoc2c1 34a_100000089557_100009817552 [0,0,0,0,0,1|2,0,1]=4 726 B15R2.7688 C[C@@H](O)COc1ccc2ccoc2c1 7a_100000089557_100009817552 [0,0,0,0,0,1|2,0,1]=4 727 B15R2.7688 C[C@@H](O)COc1ccc2cnoc2c1 34a_100000098417_100009817552 [0,0,0,0,0,1|3,0,0]=4 728 B15R2.7688 C[C@@H](O)COc1ccc2cnoc2c1 7a_100000098417_100009817552 [0,0,0,0,0,1|3,0,0]=4 729 B15R2.7688 C[C@@H](O)COc1ccc2occc2c1 34a_100000070125_100009817552 [0,0,0,0,0,1|2,0,1]=4 730 B15R2.7688 C[C@@H](O)COc1ccc2occc2c1 7a_100000070125_100009817552 [0,0,0,0,0,1|2,0,1]=4 731 B15R2.7688 C[C@@H](O)CSc1cc2c(cn1)OCC2 62a_100009817552_102495363667 [0,0,0,0,0,1|3,0,0]=4 732 B15R2.7688 C[C@@H](O)CSc1cc2c(cn1)OCC2 62a_102495363667_100009817552 [0,0,0,0,0,1|3,0,0]=4 733 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCC2 62a_100000745594_100009817552 [0,0,0,0,0,1|3,0,0]=4 734 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCC2 62a_100009817552_100000745594 [0,0,0,0,0,1|3,0,0]=4 735 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCN2 62a_100000691068_100009817552 [0,0,0,0,0,1|3,0,0]=4 736 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCN2 62a_100009817552_100000691068 [0,0,0,0,0,1|3,0,0]=4 737 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCO2 62a_100000729065_100009817552 [0,0,0,0,0,1|2,0,0]=3 738 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)CCO2 62a_100009817552_100000729065 [0,0,0,0,0,1|2,0,0]=3 739 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)NCC2 62a_100000754641_100009817552 [0,0,0,0,0,1|3,0,0]=4 740 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)NCC2 62a_100009817552_100000754641 [0,0,0,0,0,1|3,0,0]=4 741 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)OCC2 62a_100009817552_100009818566 [0,0,0,0,0,1|2,0,0]=3 742 B15R2.7688 C[C@@H](O)CSc1ccc2c(c1)OCC2 62a_100009818566_100009817552 [0,0,0,0,0,1|2,0,0]=3 743 B15R2.7688 C[C@@H](O)CSc1ccc2ccoc2c1 62a_100009817552_100000759542 [0,0,0,0,0,1|2,0,1]=4 744 B15R2.7688 C[C@@H](O)CSc1ccc2cnoc2c1 62a_100009817552_100009817722 [0,0,0,0,0,1|3,0,0]=4 745 B15R2.7688 C[C@@H](O)CSc1ccc2ncoc2c1 62a_100009817552_100009817590 [0,0,0,0,0,1|2,0,1]=4 746 B15R2.7688 C[C@@H](O)CSc1ccc2occc2c1 62a_100009817552_100000691453 [0,0,0,0,0,1|2,0,1]=4 747 B15R2.7688 C[C@@H](O)CSc1ccc2ocnc2c1 62a_100009817552_100009816175 [0,0,0,0,0,1|2,0,1]=4 748 B15R2.7688 C[C@@H](O)CSc1ccc2oncc2c1 62a_100009817552_100009817723 [0,0,0,0,0,1|3,0,0]=4 749 B15R2.7688 FC(F)CNc1ccc2c(c1)CCO2 2230a_100000736984_100011934356 [0,0,0,0,0,1|3,0,0]=4 750 B15R2.7688 FC(F)CNc1ccc2c(c1)CCO2 34a_100000736984_100011934356 [0,0,0,0,0,1|3,0,0]=4 751 B15R2.7688 FC(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011934356 [0,0,0,0,0,1|2,0,0]=3 752 B15R2.7688 FC(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100011934356 [0,0,0,0,0,1|2,0,0]=3 753 B15R2.7688 FC(F)COc1ccc2c(c1)OCO2 34a_100000210298_100011934356 [0,0,0,0,0,1|2,0,0]=3 754 B15R2.7688 FC(F)CSc1ccc2c(c1)CCO2 62a_100000729065_100011934356 [0,0,0,0,0,1|3,0,0]=4 755 B15R2.7688 FC(F)CSc1ccc2c(c1)CCO2 62a_100011934356_100000729065 [0,0,0,0,0,1|3,0,0]=4 756 B15R2.7688 FC(F)CSc1ccc2c(c1)OCC2 62a_100009818566_100011934356 [0,0,0,0,0,1|3,0,0]=4 757 B15R2.7688 FC(F)CSc1ccc2c(c1)OCC2 62a_100011934356_100009818566 [0,0,0,0,0,1|3,0,0]=4 758 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000747473 [0,0,0,0,0,1|2,0,1]=4 759 B15R2.7688 NC(=O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000187820 [0,0,0,0,0,1|2,0,1]=4 760 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747473 [0,0,0,0,0,1|1,0,1]=3 761 B15R2.7688 NC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000187820 [0,0,0,0,0,1|1,0,1]=3 762 B15R2.7688 NC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000187820 [0,0,0,0,0,1|1,0,1]=3 763 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000747473 [0,0,0,0,0,1|2,0,1]=4 764 B15R2.7688 NC(=O)CSc1ccc2c(c1)CCO2 62a_100000747473_100000729065 [0,0,0,0,0,1|2,0,1]=4 765 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100000747473_100009818566 [0,0,0,0,0,1|2,0,1]=4 766 B15R2.7688 NC(=O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000747473 [0,0,0,0,0,1|2,0,1]=4 767 B15R2.7688 O=C([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100020667443 [0,0,0,0,0,1|2,0,1]=4 768 B15R2.7688 O=C([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100020667443 [0,0,0,0,0,1|2,0,1]=4 769 B15R2.7688 O=[N+]([O-])CNc1ccc2c(c1)OCO2 34a_100000209953_100000761209 [0,0,0,0,0,1|3,0,0]=4 770 B15R2.7688 O=[N+]([O-])COc1ccc2c(c1)OCO2 34a_100000210298_100000761209 [0,0,0,0,0,1|3,0,0]=4 771 B15R2.7688 [13CH3]C(=O)C=Cc1ccc2c(c1)OCO2 1458a_100000182195_200025704644 [0,0,0,0,0,1|1,0,2]=4 772 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)CCO2 1458a_100000686558_200025704644 [0,0,0,0,0,1|2,0,1]=4 773 B15R2.7688 [13CH3]C(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_200025704644 [0,0,0,0,0,1|1,0,1]=3 774 B15R2.7688 [13CH3]C(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_200025704644 [0,0,0,0,0,1|1,0,1]=3 775 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100000070787_100000067286 [1,0,1,0,0,0|1,0,1]=4 776 B12R1.4 CC(=O)Cc1ccc(cc1)CO 1458a_100011356463_200000210301 [1,0,1,0,0,0|1,0,1]=4 777 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 34a_100011218180_200025704644 [1,0,1,0,0,0|1,0,1]=4 778 B12R1.4 CC(=O)Cc1ccc(cc1)O[13CH3] 7a_100011218180_200025704644 [1,0,1,0,0,0|1,0,1]=4 779 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 2230a_100000687309_200025704644 [1,0,1,0,0,0|2,0,0]=4 780 B12R1.4 CC(C)Cc1ccc(cc1)N[13CH3] 34a_100000687309_200025704644 [1,0,1,0,0,0|2,0,0]=4 781 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_100011221366_200025704644 [1,0,1,0,0,0|1,1,0]=4 782 B12R1.4 CC(C)Cc1ccc(cc1)S[13CH3] 62a_200025704644_100011221366 [1,0,1,0,0,0|1,1,0]=4 783 B12R1.4 CC(C)Nc1ccc(cc1)CO 2230a_100011215238_100000210206 [1,0,1,0,0,0|2,0,0]=4 784 B12R1.4 CC(C)Nc1ccc(cc1)CO 34a_100011215238_100000210206 [1,0,1,0,0,0|2,0,0]=4 785 B12R1.4 CC(C)Oc1ccc(cc1)CO 34a_100000211755_100000210206 [1,0,1,0,0,0|2,0,0]=4 786 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 34a_100000757185_200025704644 [1,0,1,0,0,0|2,0,0]=4 787 B12R1.4 CC(C)Oc1ccc(cc1)O[13CH3] 7a_100000757185_200025704644 [1,0,1,0,0,0|2,0,0]=4 788 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000210206_100000690907 [1,0,1,0,0,0|2,0,0]=4 789 B12R1.4 CC(C)Sc1ccc(cc1)CO 62a_100000690907_100000210206 [1,0,1,0,0,0|2,0,0]=4 790 B12R1.4 CC(N)Cc1ccc(cc1)O[13CH3] 34a_100102634573_200025704644 [1,0,1,0,0,0|0,0,0]=2 791 B12R1.4 CN(C)Cc1ccc(cc1)CO 2230a_100102631434_100000067286 [1,0,1,0,0,0|2,0,0]=4 792 B12R1.4 CN(C)Cc1ccc(cc1)CO 269982a_100102631434_100000067286 [1,0,1,0,0,0|2,0,0]=4 793 B12R1.4 CN(C)Cc1ccc(cc1)CO 270004a_100102631434_100009832023 [1,0,1,0,0,0|2,0,0]=4 794 B12R1.4 CNc1ccc(cc1)CC(C)C 2230a_100000687309_200000210301 [1,0,1,0,0,0|2,0,0]=4 795 B12R1.4 CNc1ccc(cc1)CC(C)C 34a_100000687309_200000210301 [1,0,1,0,0,0|2,0,0]=4 796 B12R1.4 COc1ccc(cc1)CC(=O)C 1458a_100000210706_200000210301 [1,0,1,0,0,0|1,0,1]=4 797 B12R1.4 COc1ccc(cc1)CC(=O)C 34a_100011218180_200000210301 [1,0,1,0,0,0|1,0,1]=4 798 B12R1.4 COc1ccc(cc1)CC(=O)C 7a_100011218180_200000210301 [1,0,1,0,0,0|1,0,1]=4 799 B12R1.4 COc1ccc(cc1)CC(=O)N 34a_100000020825_200000210301 [1,0,1,0,0,0|1,0,1]=4 800 B12R1.4 COc1ccc(cc1)CC(=O)[13CH3] 1458a_100000210706_200025704644 [1,0,1,0,0,0|1,0,1]=4 801 B12R1.4 COc1ccc(cc1)CC(C)N 34a_100102634573_200000210301 [1,0,1,0,0,0|0,0,0]=2 802 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100000184145_200000210301 [1,0,1,0,0,0|2,0,0]=4 803 B12R1.4 COc1ccc(cc1)CN(C)C 2230a_100102631434_100000742318 [1,0,1,0,0,0|2,0,0]=4 804 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100000184145_200000210301 [1,0,1,0,0,0|2,0,0]=4 805 B12R1.4 COc1ccc(cc1)CN(C)C 269982a_100102631434_100000742318 [1,0,1,0,0,0|2,0,0]=4 806 B12R1.4 COc1ccc(cc1)CN(C)C 270004a_100102631434_100000169835 [1,0,1,0,0,0|2,0,0]=4 807 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 2230a_100000184145_200025704644 [1,0,1,0,0,0|2,0,0]=4 808 B12R1.4 COc1ccc(cc1)CN(C)[13CH3] 269982a_100000184145_200025704644 [1,0,1,0,0,0|2,0,0]=4 809 B12R1.4 COc1ccc(cc1)NC(C)C 34a_100000184247_100000210206 [1,0,1,0,0,0|2,0,0]=4 810 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000210503_100000210206 [1,0,1,0,0,0|2,0,0]=4 811 B12R1.4 COc1ccc(cc1)OC(C)C 34a_100000757185_200000210301 [1,0,1,0,0,0|2,0,0]=4 812 B12R1.4 COc1ccc(cc1)OC(C)C 7a_100000757185_200000210301 [1,0,1,0,0,0|2,0,0]=4 813 B12R1.4 COc1ccc(cc1)SC(C)C 62a_100000210206_100000171711 [1,0,1,0,0,0|2,0,0]=4 814 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_100011221366_200000210301 [1,0,1,0,0,0|1,1,0]=4 815 B12R1.4 CSc1ccc(cc1)CC(C)C 62a_200000210301_100011221366 [1,0,1,0,0,0|1,1,0]=4 816 B12R1.4 [13CH3]C(=O)Cc1ccc(cc1)CO 1458a_100011356463_200025704644 [1,0,1,0,0,0|1,0,1]=4 817 B12R1.4 [13CH3]Oc1ccc(cc1)CC(=O)N 34a_100000020825_200025704644 [1,0,1,0,0,0|1,0,1]=4 818 B12R1.19 CC(=O)Cc1ccc(c(c1)C)O 1458a_100000083968_200000210301 [1,0,1,0,0,0|1,0,1]=4 819 B12R1.19 CC(=O)Cc1ccc(c(c1)O)C 1458a_100000082272_200000210301 [1,0,1,0,0,0|1,0,1]=4 820 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200000210301 [1,0,1,0,0,0|1,0,1]=4 821 B12R1.19 CC(=O)Cc1ccc(c(c1)O)O 271570a_203496583355_100010141077 [1,0,1,0,0,0|1,0,1]=4 822 B12R1.19 CC(C)Nc1ccc(c(c1)O)O 34a_100102946323_100000210206 [1,0,1,0,0,0|2,0,0]=4 823 B12R1.19 CC(C)Sc1ccc(c(c1)O)O 62a_100000210206_100009813601 [1,0,1,0,0,0|2,0,0]=4 824 B12R1.19 Cc1cc(ccc1O)CC(=O)[13CH3] 1458a_100000083968_200025704644 [1,0,1,0,0,0|1,0,1]=4 825 B12R1.19 Cc1cc(ccc1O)NC(C)C 34a_100011218179_100000210206 [1,0,1,0,0,0|2,0,0]=4 826 B12R1.19 Cc1cc(ccc1O)NC(C)C 7a_100011218179_100000210206 [1,0,1,0,0,0|2,0,0]=4 827 B12R1.19 Cc1cc(ccc1O)SC(C)C 62a_100000210206_100000186361 [1,0,1,0,0,0|2,0,0]=4 828 B12R1.19 Cc1ccc(cc1O)CC(=O)[13CH3] 1458a_100000082272_200025704644 [1,0,1,0,0,0|1,0,1]=4 829 B12R1.19 Cc1ccc(cc1O)NC(C)C 34a_100000759471_100000210206 [1,0,1,0,0,0|2,0,0]=4 830 B12R1.19 Cc1ccc(cc1O)NC(C)C 7a_100000759471_100000210206 [1,0,1,0,0,0|2,0,0]=4 831 B12R1.19 Cc1ccc(cc1O)OC(C)C 271570a_203496583355_200010081138 [1,0,1,0,0,0|2,0,0]=4 832 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000210206_100000685420 [1,0,1,0,0,0|2,0,0]=4 833 B12R1.19 Cc1ccc(cc1O)SC(C)C 62a_100000685420_100000210206 [1,0,1,0,0,0|2,0,0]=4 834 B12R1.19 [13CH3]C(=O)Cc1ccc(c(c1)O)O 1458a_100000031429_200025704644 [1,0,1,0,0,0|1,0,1]=4 835 B12R1.288 CC=Cc1ccc(c(c1)O)OC 271570a_100016259895_100009816560 [1,0,1,0,0,0|0,0,2]=4 836 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200000210301_200010686677 [1,0,1,0,0,0|1,1,0]=4 837 B12R1.288 CCCc1ccc(c(c1)F)SC 62a_200010686677_200000210301 [1,0,1,0,0,0|1,1,0]=4 838 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200010686677_200025704644 [1,0,1,0,0,0|1,1,0]=4 839 B12R1.288 CCCc1ccc(c(c1)F)S[13CH3] 62a_200025704644_200010686677 [1,0,1,0,0,0|1,1,0]=4 840 B12R1.288 CCNc1ccc(c(c1)Br)OC 34a_100000187427_100000210202 [1,0,1,0,0,0|2,0,0]=4 841 B12R1.288 CCNc1ccc(c(c1)C)OC 2230a_100000743268_100000210202 [1,0,1,0,0,0|2,0,0]=4 842 B12R1.288 CCNc1ccc(c(c1)C)OC 34a_100000743268_100000210202 [1,0,1,0,0,0|2,0,0]=4 843 B12R1.288 CCNc1ccc(c(c1)C)OC 7a_100000743268_100000210202 [1,0,1,0,0,0|2,0,0]=4 844 B12R1.288 CCNc1ccc(c(c1)Cl)OC 2230a_100000211044_100000210202 [1,0,1,0,0,0|2,0,0]=4 845 B12R1.288 CCNc1ccc(c(c1)Cl)OC 34a_100000211044_100000210202 [1,0,1,0,0,0|2,0,0]=4 846 B12R1.288 CCNc1ccc(c(c1)F)OC 2230a_100000740183_100000210202 [1,0,1,0,0,0|2,0,0]=4 847 B12R1.288 CCNc1ccc(c(c1)F)OC 34a_100000740183_100000210202 [1,0,1,0,0,0|2,0,0]=4 848 B12R1.288 CCNc1ccc(c(c1)I)OC 34a_100011356947_100000210202 [1,0,1,0,0,0|2,0,0]=4 849 B12R1.288 CCNc1ccc(c(c1)O)OC 34a_100000211920_100000210202 [1,0,1,0,0,0|1,0,0]=3 850 B12R1.288 CCOc1ccc(c(c1)Br)OC 34a_100010234764_100000210202 [1,0,1,0,0,0|2,0,0]=4 851 B12R1.288 CCOc1ccc(c(c1)Br)OC 7a_100010234764_100000210202 [1,0,1,0,0,0|2,0,0]=4 852 B12R1.288 CCOc1ccc(c(c1)C)OC 34a_100000759738_100000210202 [1,0,1,0,0,0|2,0,0]=4 853 B12R1.288 CCOc1ccc(c(c1)C)OC 7a_100000759738_100000210202 [1,0,1,0,0,0|2,0,0]=4 854 B12R1.288 CCOc1ccc(c(c1)Cl)OC 34a_200009861682_100000210202 [1,0,1,0,0,0|2,0,0]=4 855 B12R1.288 CCOc1ccc(c(c1)Cl)OC 7a_200009861682_100000210202 [1,0,1,0,0,0|2,0,0]=4 856 B12R1.288 CCOc1ccc(c(c1)F)OC 34a_100000746305_100000210202 [1,0,1,0,0,0|2,0,0]=4 857 B12R1.288 CCOc1ccc(c(c1)F)OC 7a_100000746305_100000210202 [1,0,1,0,0,0|2,0,0]=4 858 B12R1.288 CCOc1ccc(c(c1)I)OC 34a_100010084122_100000210202 [1,0,1,0,0,0|2,0,0]=4 859 B12R1.288 CCOc1ccc(c(c1)I)OC 7a_100010084122_100000210202 [1,0,1,0,0,0|2,0,0]=4 860 B12R1.288 CCSc1cc(c(cn1)OC)O 62a_100000210202_100010264082 [1,0,1,0,0,0|2,0,0]=4 861 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100000210202_100011249507 [1,0,1,0,0,0|2,0,0]=4 862 B12R1.288 CCSc1ccc(c(c1)Br)OC 62a_100011249507_100000210202 [1,0,1,0,0,0|2,0,0]=4 863 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100000210202_100011219705 [1,0,1,0,0,0|2,0,0]=4 864 B12R1.288 CCSc1ccc(c(c1)C)OC 62a_100011219705_100000210202 [1,0,1,0,0,0|2,0,0]=4 865 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100000210202_100012355395 [1,0,1,0,0,0|2,0,0]=4 866 B12R1.288 CCSc1ccc(c(c1)Cl)OC 62a_100012355395_100000210202 [1,0,1,0,0,0|2,0,0]=4 867 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000171752_100000210202 [1,0,1,0,0,0|2,0,0]=4 868 B12R1.288 CCSc1ccc(c(c1)F)OC 62a_100000210202_100000171752 [1,0,1,0,0,0|2,0,0]=4 869 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100000210202_100011249504 [1,0,1,0,0,0|2,0,0]=4 870 B12R1.288 CCSc1ccc(c(c1)N)OC 62a_100011249504_100000210202 [1,0,1,0,0,0|2,0,0]=4 871 B12R1.288 CCSc1ccc(c(c1)O)OC 62a_100000210202_100009816560 [1,0,1,0,0,0|1,0,0]=3 872 B12R1.288 CCSc1cnc(c(c1)O)OC 62a_100000210202_100010135713 [1,0,1,0,0,0|2,0,0]=4 873 B12R1.288 CNCc1ccc(c(c1)Br)OC 207a_100102657272_100000173361 [1,0,1,0,0,0|2,0,0]=4 874 B12R1.288 CNCc1ccc(c(c1)Br)OC 2230a_106832991635_200011397701 [1,0,1,0,0,0|2,0,0]=4 875 B12R1.288 CNCc1ccc(c(c1)Br)OC 26a_100102657272_100010234764 [1,0,1,0,0,0|2,0,0]=4 876 B12R1.288 CNCc1ccc(c(c1)Br)OC 270004a_106832991635_100000173361 [1,0,1,0,0,0|2,0,0]=4 877 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100102657272_200011397701 [1,0,1,0,0,0|2,0,0]=4 878 B12R1.288 CNCc1ccc(c(c1)Br)OC 34a_100159240714_200000210301 [1,0,1,0,0,0|2,0,0]=4 879 B12R1.288 CNCc1ccc(c(c1)Br)OC 7a_106832991635_200011397701 [1,0,1,0,0,0|2,0,0]=4 880 B12R1.288 CNCc1ccc(c(c1)C)OC 207a_100102657272_100000239718 [1,0,1,0,0,0|2,0,0]=4 881 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_100102679029_200000210301 [1,0,1,0,0,0|2,0,0]=4 882 B12R1.288 CNCc1ccc(c(c1)C)OC 2230a_106832991635_200011290836 [1,0,1,0,0,0|2,0,0]=4 883 B12R1.288 CNCc1ccc(c(c1)C)OC 270004a_106832991635_100000239718 [1,0,1,0,0,0|2,0,0]=4 884 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102657272_200011290836 [1,0,1,0,0,0|2,0,0]=4 885 B12R1.288 CNCc1ccc(c(c1)C)OC 34a_100102679029_200000210301 [1,0,1,0,0,0|2,0,0]=4 886 B12R1.288 CNCc1ccc(c(c1)C)OC 7a_106832991635_200011290836 [1,0,1,0,0,0|2,0,0]=4 887 B12R1.288 CNCc1ccc(c(c1)Cl)OC 207a_100102657272_100000186747 [1,0,1,0,0,0|2,0,0]=4 888 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_100000008799_200000210301 [1,0,1,0,0,0|2,0,0]=4 889 B12R1.288 CNCc1ccc(c(c1)Cl)OC 2230a_106832991635_100000693707 [1,0,1,0,0,0|2,0,0]=4 890 B12R1.288 CNCc1ccc(c(c1)Cl)OC 26a_100102657272_200009861682 [1,0,1,0,0,0|2,0,0]=4 891 B12R1.288 CNCc1ccc(c(c1)Cl)OC 270004a_106832991635_100000186747 [1,0,1,0,0,0|2,0,0]=4 892 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100000008799_200000210301 [1,0,1,0,0,0|2,0,0]=4 893 B12R1.288 CNCc1ccc(c(c1)Cl)OC 34a_100102657272_100000693707 [1,0,1,0,0,0|2,0,0]=4 894 B12R1.288 CNCc1ccc(c(c1)Cl)OC 7a_106832991635_100000693707 [1,0,1,0,0,0|2,0,0]=4 895 B12R1.288 CNCc1ccc(c(c1)F)OC 207a_100102657272_100000204617 [1,0,1,0,0,0|2,0,0]=4 896 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_100000737316_200000210301 [1,0,1,0,0,0|2,0,0]=4 897 B12R1.288 CNCc1ccc(c(c1)F)OC 2230a_106832991635_100000189595 [1,0,1,0,0,0|2,0,0]=4 898 B12R1.288 CNCc1ccc(c(c1)F)OC 270004a_106832991635_100000204617 [1,0,1,0,0,0|2,0,0]=4 899 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100000737316_200000210301 [1,0,1,0,0,0|2,0,0]=4 900 B12R1.288 CNCc1ccc(c(c1)F)OC 34a_100102657272_100000189595 [1,0,1,0,0,0|2,0,0]=4 901 B12R1.288 CNCc1ccc(c(c1)F)OC 7a_106832991635_100000189595 [1,0,1,0,0,0|2,0,0]=4 902 B12R1.288 CNCc1ccc(c(c1)I)OC 207a_100102657272_100009827998 [1,0,1,0,0,0|2,0,0]=4 903 B12R1.288 CNCc1ccc(c(c1)I)OC 270004a_106832991635_100009827998 [1,0,1,0,0,0|2,0,0]=4 904 B12R1.288 CNCc1ccc(c(c1)O)OC 34a_100000740000_200000210301 [1,0,1,0,0,0|1,0,0]=3 905 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100000246451_200000210301 [1,0,1,0,0,0|2,0,0]=4 906 B12R1.288 COCc1ccc(c(c1)Br)OC 34a_100138415774_200011397701 [1,0,1,0,0,0|2,0,0]=4 907 B12R1.288 COCc1ccc(c(c1)Br)OC 7a_100000246451_200000210301 [1,0,1,0,0,0|2,0,0]=4 908 B12R1.288 COCc1ccc(c(c1)C)OC 34a_100138415774_200011290836 [1,0,1,0,0,0|2,0,0]=4 909 B12R1.288 COCc1ccc(c(c1)C)OC 34a_200011290855_200000210301 [1,0,1,0,0,0|2,0,0]=4 910 B12R1.288 COCc1ccc(c(c1)C)OC 7a_200011290855_200000210301 [1,0,1,0,0,0|2,0,0]=4 911 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100000694469_200000210301 [1,0,1,0,0,0|2,0,0]=4 912 B12R1.288 COCc1ccc(c(c1)Cl)OC 34a_100138415774_100000693707 [1,0,1,0,0,0|2,0,0]=4 913 B12R1.288 COCc1ccc(c(c1)Cl)OC 7a_100000694469_200000210301 [1,0,1,0,0,0|2,0,0]=4 914 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100000246395_200000210301 [1,0,1,0,0,0|2,0,0]=4 915 B12R1.288 COCc1ccc(c(c1)F)OC 34a_100138415774_100000189595 [1,0,1,0,0,0|2,0,0]=4 916 B12R1.288 COCc1ccc(c(c1)F)OC 7a_100000246395_200000210301 [1,0,1,0,0,0|2,0,0]=4 917 B12R1.288 COCc1ccc(c(c1)I)OC 34a_200000013966_200000210301 [1,0,1,0,0,0|2,0,0]=4 918 B12R1.288 COCc1ccc(c(c1)I)OC 7a_200000013966_200000210301 [1,0,1,0,0,0|2,0,0]=4 919 B12R1.288 COCc1ccc(c(c1)N)OC 34a_100011269841_200000210301 [1,0,1,0,0,0|2,0,0]=4 920 B12R1.288 COc1ccc(cc1Br)CN[13CH3] 34a_100159240714_200025704644 [1,0,1,0,0,0|2,0,0]=4 921 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 34a_100000246451_200025704644 [1,0,1,0,0,0|2,0,0]=4 922 B12R1.288 COc1ccc(cc1Br)CO[13CH3] 7a_100000246451_200025704644 [1,0,1,0,0,0|2,0,0]=4 923 B12R1.288 COc1ccc(cc1Br)CSC 62a_200000210301_200011397701 [1,0,1,0,0,0|2,0,0]=4 924 B12R1.288 COc1ccc(cc1Br)CSC 62a_200011397701_200000210301 [1,0,1,0,0,0|2,0,0]=4 925 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200011397701_200025704644 [1,0,1,0,0,0|2,0,0]=4 926 B12R1.288 COc1ccc(cc1Br)CS[13CH3] 62a_200025704644_200011397701 [1,0,1,0,0,0|2,0,0]=4 927 B12R1.288 COc1ccc(cc1C)CN[13CH3] 2230a_100102679029_200025704644 [1,0,1,0,0,0|2,0,0]=4 928 B12R1.288 COc1ccc(cc1C)CN[13CH3] 34a_100102679029_200025704644 [1,0,1,0,0,0|2,0,0]=4 929 B12R1.288 COc1ccc(cc1C)CO[13CH3] 34a_200011290855_200025704644 [1,0,1,0,0,0|2,0,0]=4 930 B12R1.288 COc1ccc(cc1C)CO[13CH3] 7a_200011290855_200025704644 [1,0,1,0,0,0|2,0,0]=4 931 B12R1.288 COc1ccc(cc1C)CSC 62a_200000210301_200011290836 [1,0,1,0,0,0|2,0,0]=4 932 B12R1.288 COc1ccc(cc1C)CSC 62a_200011290836_200000210301 [1,0,1,0,0,0|2,0,0]=4 933 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200011290836_200025704644 [1,0,1,0,0,0|2,0,0]=4 934 B12R1.288 COc1ccc(cc1C)CS[13CH3] 62a_200025704644_200011290836 [1,0,1,0,0,0|2,0,0]=4 935 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 2230a_100000008799_200025704644 [1,0,1,0,0,0|2,0,0]=4 936 B12R1.288 COc1ccc(cc1Cl)CN[13CH3] 34a_100000008799_200025704644 [1,0,1,0,0,0|2,0,0]=4 937 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 34a_100000694469_200025704644 [1,0,1,0,0,0|2,0,0]=4 938 B12R1.288 COc1ccc(cc1Cl)CO[13CH3] 7a_100000694469_200025704644 [1,0,1,0,0,0|2,0,0]=4 939 B12R1.288 COc1ccc(cc1Cl)CSC 62a_100000693707_200000210301 [1,0,1,0,0,0|2,0,0]=4 940 B12R1.288 COc1ccc(cc1Cl)CSC 62a_200000210301_100000693707 [1,0,1,0,0,0|2,0,0]=4 941 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_100000693707_200025704644 [1,0,1,0,0,0|2,0,0]=4 942 B12R1.288 COc1ccc(cc1Cl)CS[13CH3] 62a_200025704644_100000693707 [1,0,1,0,0,0|2,0,0]=4 943 B12R1.288 COc1ccc(cc1F)CN[13CH3] 2230a_100000737316_200025704644 [1,0,1,0,0,0|2,0,0]=4 944 B12R1.288 COc1ccc(cc1F)CN[13CH3] 34a_100000737316_200025704644 [1,0,1,0,0,0|2,0,0]=4 945 B12R1.288 COc1ccc(cc1F)CO[13CH3] 34a_100000246395_200025704644 [1,0,1,0,0,0|2,0,0]=4 946 B12R1.288 COc1ccc(cc1F)CO[13CH3] 7a_100000246395_200025704644 [1,0,1,0,0,0|2,0,0]=4 947 B12R1.288 COc1ccc(cc1F)CSC 62a_100000189595_200000210301 [1,0,1,0,0,0|2,0,0]=4 948 B12R1.288 COc1ccc(cc1F)CSC 62a_200000210301_100000189595 [1,0,1,0,0,0|2,0,0]=4 949 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_100000189595_200025704644 [1,0,1,0,0,0|2,0,0]=4 950 B12R1.288 COc1ccc(cc1F)CS[13CH3] 62a_200025704644_100000189595 [1,0,1,0,0,0|2,0,0]=4 951 B12R1.288 COc1ccc(cc1I)CO[13CH3] 34a_200000013966_200025704644 [1,0,1,0,0,0|2,0,0]=4 952 B12R1.288 COc1ccc(cc1I)CO[13CH3] 7a_200000013966_200025704644 [1,0,1,0,0,0|2,0,0]=4 953 B12R1.288 COc1ccc(cc1N)CO[13CH3] 34a_100011269841_200025704644 [1,0,1,0,0,0|2,0,0]=4 954 B12R1.288 COc1ccc(cc1O)CC#N 271570a_203496583355_100011215974 [1,0,1,0,0,0|0,0,2]=4 955 B12R1.288 COc1ccc(cc1O)CCN 271570a_203496583355_103549771065 [1,0,1,0,0,0|0,0,0]=2 956 B12R1.288 COc1ccc(cc1O)CCO 271570a_203496583355_100011962876 [1,0,1,0,0,0|1,0,0]=3 957 B12R1.288 COc1ccc(cc1O)CN[13CH3] 34a_100000740000_200025704644 [1,0,1,0,0,0|1,0,0]=3 958 B12R1.288 COc1ccc(cc1O)NCF 34a_100000211920_100015361967 [1,0,1,0,0,0|2,0,0]=4 959 B12R1.288 COc1ccc(cc1O)SCF 62a_100015361967_100009816560 [1,0,1,0,0,0|2,0,0]=4 960 B12R1.286 CC=Cc1ccc(c(c1)OC)O 271570a_100016259895_100000694246 [1,0,1,0,0,0|0,0,2]=4 961 B12R1.286 CCNc1ccc(c(c1)OC)Br 2230a_100000765947_100000210202 [1,0,1,0,0,0|2,0,0]=4 962 B12R1.286 CCNc1ccc(c(c1)OC)Br 34a_100000765947_100000210202 [1,0,1,0,0,0|2,0,0]=4 963 B12R1.286 CCNc1ccc(c(c1)OC)C 2230a_100011279678_100000210202 [1,0,1,0,0,0|2,0,0]=4 964 B12R1.286 CCNc1ccc(c(c1)OC)C 34a_100011279678_100000210202 [1,0,1,0,0,0|2,0,0]=4 965 B12R1.286 CCNc1ccc(c(c1)OC)Cl 2230a_100000742311_100000210202 [1,0,1,0,0,0|2,0,0]=4 966 B12R1.286 CCNc1ccc(c(c1)OC)Cl 34a_100000742311_100000210202 [1,0,1,0,0,0|2,0,0]=4 967 B12R1.286 CCNc1ccc(c(c1)OC)F 2230a_100000701188_100000210202 [1,0,1,0,0,0|2,0,0]=4 968 B12R1.286 CCNc1ccc(c(c1)OC)F 34a_100000701188_100000210202 [1,0,1,0,0,0|2,0,0]=4 969 B12R1.286 CCNc1ccc(c(c1)OC)I 34a_100000746945_100000210202 [1,0,1,0,0,0|2,0,0]=4 970 B12R1.286 CCNc1ccc(c(c1)OC)O 34a_100000726020_100000210202 [1,0,1,0,0,0|1,0,0]=3 971 B12R1.286 CCOc1ccc(c(c1)OC)Br 34a_100011827694_100000210202 [1,0,1,0,0,0|2,0,0]=4 972 B12R1.286 CCOc1ccc(c(c1)OC)Br 7a_100011827694_100000210202 [1,0,1,0,0,0|2,0,0]=4 973 B12R1.286 CCOc1ccc(c(c1)OC)C 34a_100009865632_100000210202 [1,0,1,0,0,0|2,0,0]=4 974 B12R1.286 CCOc1ccc(c(c1)OC)C 7a_100009865632_100000210202 [1,0,1,0,0,0|2,0,0]=4 975 B12R1.286 CCOc1ccc(c(c1)OC)Cl 34a_100012186310_100000210202 [1,0,1,0,0,0|2,0,0]=4 976 B12R1.286 CCOc1ccc(c(c1)OC)Cl 7a_100012186310_100000210202 [1,0,1,0,0,0|2,0,0]=4 977 B12R1.286 CCOc1ccc(c(c1)OC)F 34a_100012001760_100000210202 [1,0,1,0,0,0|2,0,0]=4 978 B12R1.286 CCOc1ccc(c(c1)OC)F 7a_100012001760_100000210202 [1,0,1,0,0,0|2,0,0]=4 979 B12R1.286 CCOc1ccc(c(c1)OC)N 34a_100015326901_100000210202 [1,0,1,0,0,0|2,0,0]=4 980 B12R1.286 CCOc1ccc(c(c1)OC)N 7a_100015326901_100000210202 [1,0,1,0,0,0|2,0,0]=4 981 B12R1.286 CCSc1ccc(c(c1)CC)O 62a_100000210202_100012338938 [1,0,1,0,0,0|2,0,0]=4 982 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100000210202_100012353699 [1,0,1,0,0,0|2,0,0]=4 983 B12R1.286 CCSc1ccc(c(c1)OC)Br 62a_100012353699_100000210202 [1,0,1,0,0,0|2,0,0]=4 984 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100000210202_100011830276 [1,0,1,0,0,0|2,0,0]=4 985 B12R1.286 CCSc1ccc(c(c1)OC)C 62a_100011830276_100000210202 [1,0,1,0,0,0|2,0,0]=4 986 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100000210202_100011356853 [1,0,1,0,0,0|2,0,0]=4 987 B12R1.286 CCSc1ccc(c(c1)OC)Cl 62a_100011356853_100000210202 [1,0,1,0,0,0|2,0,0]=4 988 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100000210202_100011934186 [1,0,1,0,0,0|2,0,0]=4 989 B12R1.286 CCSc1ccc(c(c1)OC)F 62a_100011934186_100000210202 [1,0,1,0,0,0|2,0,0]=4 990 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100000210202_100015196925 [1,0,1,0,0,0|2,0,0]=4 991 B12R1.286 CCSc1ccc(c(c1)OC)N 62a_100011279103_100000210202 [1,0,1,0,0,0|2,0,0]=4 992 B12R1.286 CCSc1ccc(c(c1)OC)O 62a_100000210202_100000694246 [1,0,1,0,0,0|1,0,0]=3 993 B12R1.286 CCSc1ccc(c(n1)OC)O 62a_100000210202_100010893133 [1,0,1,0,0,0|2,0,0]=4 994 B12R1.286 CNCc1ccc(c(c1)OC)Br 207a_100102657272_100010244714 [1,0,1,0,0,0|2,0,0]=4 995 B12R1.286 CNCc1ccc(c(c1)OC)Br 2230a_106832991635_100010110085 [1,0,1,0,0,0|2,0,0]=4 996 B12R1.286 CNCc1ccc(c(c1)OC)Br 26a_100102657272_100011827694 [1,0,1,0,0,0|2,0,0]=4 997 B12R1.286 CNCc1ccc(c(c1)OC)Br 270004a_106832991635_100010244714 [1,0,1,0,0,0|2,0,0]=4 998 B12R1.286 CNCc1ccc(c(c1)OC)Br 34a_100102657272_100010110085 [1,0,1,0,0,0|2,0,0]=4 999 B12R1.286 CNCc1ccc(c(c1)OC)Br 7a_106832991635_100010110085 [1,0,1,0,0,0|2,0,0]=4 1000 B12R1.286 CNCc1ccc(c(c1)OC)C 207a_100102657272_100000719150 [1,0,1,0,0,0|2,0,0]=4 1001 B12R1.286 CNCc1ccc(c(c1)OC)C 270004a_106832991635_100000719150 [1,0,1,0,0,0|2,0,0]=4 1002 B12R1.286 CNCc1ccc(c(c1)OC)Cl 207a_100102657272_100011998524 [1,0,1,0,0,0|2,0,0]=4 1003 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_100015204853_200000210301 [1,0,1,0,0,0|2,0,0]=4 1004 B12R1.286 CNCc1ccc(c(c1)OC)Cl 2230a_106832991635_200010214485 [1,0,1,0,0,0|2,0,0]=4 1005 B12R1.286 CNCc1ccc(c(c1)OC)Cl 26a_100102657272_100012186310 [1,0,1,0,0,0|2,0,0]=4 1006 B12R1.286 CNCc1ccc(c(c1)OC)Cl 270004a_106832991635_100011998524 [1,0,1,0,0,0|2,0,0]=4 1007 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100015204853_200000210301 [1,0,1,0,0,0|2,0,0]=4 1008 B12R1.286 CNCc1ccc(c(c1)OC)Cl 34a_100102657272_200010214485 [1,0,1,0,0,0|2,0,0]=4 1009 B12R1.286 CNCc1ccc(c(c1)OC)Cl 7a_106832991635_200010214485 [1,0,1,0,0,0|2,0,0]=4 1010 B12R1.286 CNCc1ccc(c(c1)OC)F 207a_100102657272_100000692873 [1,0,1,0,0,0|2,0,0]=4 1011 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_100020626639_200000210301 [1,0,1,0,0,0|2,0,0]=4 1012 B12R1.286 CNCc1ccc(c(c1)OC)F 2230a_106832991635_100012349856 [1,0,1,0,0,0|2,0,0]=4 1013 B12R1.286 CNCc1ccc(c(c1)OC)F 270004a_106832991635_100000692873 [1,0,1,0,0,0|2,0,0]=4 1014 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100020626639_200000210301 [1,0,1,0,0,0|2,0,0]=4 1015 B12R1.286 CNCc1ccc(c(c1)OC)F 34a_100102657272_100012349856 [1,0,1,0,0,0|2,0,0]=4 1016 B12R1.286 CNCc1ccc(c(c1)OC)F 7a_106832991635_100012349856 [1,0,1,0,0,0|2,0,0]=4 1017 B12R1.286 CNCc1ccc(c(c1)OC)O 34a_100000185554_200000210301 [1,0,1,0,0,0|1,0,0]=3 1018 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100010234685_200000210301 [1,0,1,0,0,0|2,0,0]=4 1019 B12R1.286 COCc1ccc(c(c1)OC)Br 34a_100138415774_100010110085 [1,0,1,0,0,0|2,0,0]=4 1020 B12R1.286 COCc1ccc(c(c1)OC)Br 7a_100010234685_200000210301 [1,0,1,0,0,0|2,0,0]=4 1021 B12R1.286 COCc1ccc(c(c1)OC)C 34a_100000752651_200000210301 [1,0,1,0,0,0|2,0,0]=4 1022 B12R1.286 COCc1ccc(c(c1)OC)C 7a_100000752651_200000210301 [1,0,1,0,0,0|2,0,0]=4 1023 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100012179228_200000210301 [1,0,1,0,0,0|2,0,0]=4 1024 B12R1.286 COCc1ccc(c(c1)OC)Cl 34a_100138415774_200010214485 [1,0,1,0,0,0|2,0,0]=4 1025 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100000692429_200000210301 [1,0,1,0,0,0|2,0,0]=4 1026 B12R1.286 COCc1ccc(c(c1)OC)F 34a_100138415774_100012349856 [1,0,1,0,0,0|2,0,0]=4 1027 B12R1.286 COCc1ccc(c(c1)OC)F 7a_100000692429_200000210301 [1,0,1,0,0,0|2,0,0]=4 1028 B12R1.286 COCc1ccc(c(c1)OC)N 34a_100000087641_200000210301 [1,0,1,0,0,0|2,0,0]=4 1029 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 34a_100010234685_200025704644 [1,0,1,0,0,0|2,0,0]=4 1030 B12R1.286 COc1cc(ccc1Br)CO[13CH3] 7a_100010234685_200025704644 [1,0,1,0,0,0|2,0,0]=4 1031 B12R1.286 COc1cc(ccc1Br)CSC 62a_100010110085_200000210301 [1,0,1,0,0,0|2,0,0]=4 1032 B12R1.286 COc1cc(ccc1Br)CSC 62a_200000210301_100010110085 [1,0,1,0,0,0|2,0,0]=4 1033 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_100010110085_200025704644 [1,0,1,0,0,0|2,0,0]=4 1034 B12R1.286 COc1cc(ccc1Br)CS[13CH3] 62a_200025704644_100010110085 [1,0,1,0,0,0|2,0,0]=4 1035 B12R1.286 COc1cc(ccc1C)CO[13CH3] 34a_100000752651_200025704644 [1,0,1,0,0,0|2,0,0]=4 1036 B12R1.286 COc1cc(ccc1C)CO[13CH3] 7a_100000752651_200025704644 [1,0,1,0,0,0|2,0,0]=4 1037 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 2230a_100015204853_200025704644 [1,0,1,0,0,0|2,0,0]=4 1038 B12R1.286 COc1cc(ccc1Cl)CN[13CH3] 34a_100015204853_200025704644 [1,0,1,0,0,0|2,0,0]=4 1039 B12R1.286 COc1cc(ccc1Cl)CO[13CH3] 34a_100012179228_200025704644 [1,0,1,0,0,0|2,0,0]=4 1040 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200000210301_200010214485 [1,0,1,0,0,0|2,0,0]=4 1041 B12R1.286 COc1cc(ccc1Cl)CSC 62a_200010214485_200000210301 [1,0,1,0,0,0|2,0,0]=4 1042 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200010214485_200025704644 [1,0,1,0,0,0|2,0,0]=4 1043 B12R1.286 COc1cc(ccc1Cl)CS[13CH3] 62a_200025704644_200010214485 [1,0,1,0,0,0|2,0,0]=4 1044 B12R1.286 COc1cc(ccc1F)CN[13CH3] 2230a_100020626639_200025704644 [1,0,1,0,0,0|2,0,0]=4 1045 B12R1.286 COc1cc(ccc1F)CN[13CH3] 34a_100020626639_200025704644 [1,0,1,0,0,0|2,0,0]=4 1046 B12R1.286 COc1cc(ccc1F)CO[13CH3] 34a_100000692429_200025704644 [1,0,1,0,0,0|2,0,0]=4 1047 B12R1.286 COc1cc(ccc1F)CO[13CH3] 7a_100000692429_200025704644 [1,0,1,0,0,0|2,0,0]=4 1048 B12R1.286 COc1cc(ccc1F)CSC 62a_100012349856_200000210301 [1,0,1,0,0,0|2,0,0]=4 1049 B12R1.286 COc1cc(ccc1F)CSC 62a_200000210301_100012349856 [1,0,1,0,0,0|2,0,0]=4 1050 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_100012349856_200025704644 [1,0,1,0,0,0|2,0,0]=4 1051 B12R1.286 COc1cc(ccc1F)CS[13CH3] 62a_200025704644_100012349856 [1,0,1,0,0,0|2,0,0]=4 1052 B12R1.286 COc1cc(ccc1N)CO[13CH3] 34a_100000087641_200025704644 [1,0,1,0,0,0|2,0,0]=4 1053 B12R1.286 COc1cc(ccc1O)CC#N 271570a_203496583355_100010176002 [1,0,1,0,0,0|0,0,2]=4 1054 B12R1.286 COc1cc(ccc1O)CN[13CH3] 34a_100000185554_200025704644 [1,0,1,0,0,0|1,0,0]=3 1055 B12R1.286 COc1cc(ccc1O)NCF 34a_100000726020_100015361967 [1,0,1,0,0,0|2,0,0]=4 1056 B12R1.286 COc1cc(ccc1O)SCF 62a_100015361967_100000694246 [1,0,1,0,0,0|2,0,0]=4 1057 B12R1.438 CC(=O)Cc1cccc(c1)CO 1458a_100000070787_100010188025 [1,0,1,0,0,0|1,0,1]=4 1058 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_100010883412_200025704644 [1,0,1,0,0,0|1,1,0]=4 1059 B12R1.438 CC(C)Cc1cccc(c1)S[13CH3] 62a_200025704644_100010883412 [1,0,1,0,0,0|1,1,0]=4 1060 B12R1.438 CC(C)Nc1cccc(c1)CO 2230a_100000211919_100000210206 [1,0,1,0,0,0|2,0,0]=4 1061 B12R1.438 CC(C)Nc1cccc(c1)CO 34a_100000211919_100000210206 [1,0,1,0,0,0|2,0,0]=4 1062 B12R1.438 CC(C)Oc1cccc(c1)CO 34a_100011214949_100000210206 [1,0,1,0,0,0|2,0,0]=4 1063 B12R1.438 CC(C)Oc1cccc(c1)CO 7a_100011214949_100000210206 [1,0,1,0,0,0|2,0,0]=4 1064 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 34a_100000753242_200025704644 [1,0,1,0,0,0|2,0,0]=4 1065 B12R1.438 CC(C)Oc1cccc(c1)O[13CH3] 7a_100000753242_200025704644 [1,0,1,0,0,0|2,0,0]=4 1066 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000210206_100000687537 [1,0,1,0,0,0|2,0,0]=4 1067 B12R1.438 CC(C)Sc1cccc(c1)CO 62a_100000687537_100000210206 [1,0,1,0,0,0|2,0,0]=4 1068 B12R1.438 CN(C)Cc1cccc(c1)CO 2230a_100102631434_100010188025 [1,0,1,0,0,0|2,0,0]=4 1069 B12R1.438 CN(C)Cc1cccc(c1)CO 269982a_100102631434_100010188025 [1,0,1,0,0,0|2,0,0]=4 1070 B12R1.438 CN(C)Cc1cccc(c1)CO 270004a_100102631434_200000050894 [1,0,1,0,0,0|2,0,0]=4 1071 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000070787_100000211672 [1,0,1,0,0,0|1,0,1]=4 1072 B12R1.438 COc1cccc(c1)CC(=O)C 1458a_100000211281_200000210301 [1,0,1,0,0,0|1,0,1]=4 1073 B12R1.438 COc1cccc(c1)CC(=O)N 34a_200000747573_200000210301 [1,0,1,0,0,0|1,0,1]=4 1074 B12R1.438 COc1cccc(c1)CC(=O)N 7a_200000747573_200000210301 [1,0,1,0,0,0|1,0,1]=4 1075 B12R1.438 COc1cccc(c1)CC(=O)[13CH3] 1458a_100000211281_200025704644 [1,0,1,0,0,0|1,0,1]=4 1076 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100000184262_200000210301 [1,0,1,0,0,0|2,0,0]=4 1077 B12R1.438 COc1cccc(c1)CN(C)C 2230a_100102631434_100000211672 [1,0,1,0,0,0|2,0,0]=4 1078 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100000184262_200000210301 [1,0,1,0,0,0|2,0,0]=4 1079 B12R1.438 COc1cccc(c1)CN(C)C 269982a_100102631434_100000688526 [1,0,1,0,0,0|2,0,0]=4 1080 B12R1.438 COc1cccc(c1)CN(C)C 270004a_100102631434_100000170238 [1,0,1,0,0,0|2,0,0]=4 1081 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 2230a_100000184262_200025704644 [1,0,1,0,0,0|2,0,0]=4 1082 B12R1.438 COc1cccc(c1)CN(C)[13CH3] 269982a_100000184262_200025704644 [1,0,1,0,0,0|2,0,0]=4 1083 B12R1.438 COc1cccc(c1)NC(C)C 34a_100000210024_100000210206 [1,0,1,0,0,0|2,0,0]=4 1084 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000211255_100000210206 [1,0,1,0,0,0|2,0,0]=4 1085 B12R1.438 COc1cccc(c1)OC(C)C 34a_100000753242_200000210301 [1,0,1,0,0,0|2,0,0]=4 1086 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000211255_100000210206 [1,0,1,0,0,0|2,0,0]=4 1087 B12R1.438 COc1cccc(c1)OC(C)C 7a_100000753242_200000210301 [1,0,1,0,0,0|2,0,0]=4 1088 B12R1.438 COc1cccc(c1)SC(C)C 62a_100000210206_100000170001 [1,0,1,0,0,0|2,0,0]=4 1089 B12R1.438 CSc1cccc(c1)CC(C)C 62a_100010883412_200000210301 [1,0,1,0,0,0|1,1,0]=4 1090 B12R1.438 CSc1cccc(c1)CC(C)C 62a_200000210301_100010883412 [1,0,1,0,0,0|1,1,0]=4 1091 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 34a_200000747573_200025704644 [1,0,1,0,0,0|1,0,1]=4 1092 B12R1.438 [13CH3]Oc1cccc(c1)CC(=O)N 7a_200000747573_200025704644 [1,0,1,0,0,0|1,0,1]=4 1093 B12R1.116 CCCc1ccc(cc1)NCC 2230a_100000211780_100000210202 [1,0,1,0,0,0|2,0,0]=4 1094 B12R1.116 CCCc1ccc(cc1)NCC 34a_100000211780_100000210202 [1,0,1,0,0,0|2,0,0]=4 1095 B12R1.116 CCCc1ccc(cc1)NCF 34a_100000211780_100015361967 [1,0,1,0,0,0|2,0,0]=4 1096 B12R1.116 CCCc1ccc(cc1)OCC 34a_100000749406_100000210202 [1,0,1,0,0,0|1,0,0]=3 1097 B12R1.116 CCCc1ccc(cc1)OCC 7a_100000749406_100000210202 [1,0,1,0,0,0|1,0,0]=3 1098 B12R1.116 CCCc1ccc(cc1)OCF 34a_100000749406_100015361967 [1,0,1,0,0,0|1,0,0]=3 1099 B12R1.116 CCCc1ccc(cc1)OCF 7a_100000749406_100015361967 [1,0,1,0,0,0|1,0,0]=3 1100 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000210202_100000750032 [1,0,1,0,0,0|1,1,0]=4 1101 B12R1.116 CCCc1ccc(cc1)SCC 62a_100000750032_100000210202 [1,0,1,0,0,0|1,1,0]=4 1102 B12R1.116 CCCc1ccc(cc1)SCF 62a_100000750032_100015361967 [1,0,1,0,0,0|1,1,0]=4 1103 B12R1.116 CCCc1ccc(cc1)SCF 62a_100015361967_100000750032 [1,0,1,0,0,0|1,1,0]=4 1104 B12R1.116 CCNc1ccc(cc1)CCO 2230a_100011204434_100000210202 [1,0,1,0,0,0|2,0,0]=4 1105 B12R1.116 CCNc1ccc(cc1)CCO 34a_100011204434_100000210202 [1,0,1,0,0,0|2,0,0]=4 1106 B12R1.116 CCNc1ccc(cc1)OCC 2230a_100000739623_100000210202 [1,0,1,0,0,0|2,0,0]=4 1107 B12R1.116 CCNc1ccc(cc1)OCC 34a_100000739623_100000210202 [1,0,1,0,0,0|2,0,0]=4 1108 B12R1.116 CCNc1ccc(cc1)OCC 34a_100011337800_100000210202 [1,0,1,0,0,0|2,0,0]=4 1109 B12R1.116 CCNc1ccc(cc1)OCC 7a_100011337800_100000210202 [1,0,1,0,0,0|2,0,0]=4 1110 B12R1.116 CCNc1ccc(cc1)OCF 34a_100011337800_100015361967 [1,0,1,0,0,0|2,0,0]=4 1111 B12R1.116 CCNc1ccc(cc1)OCF 7a_100011337800_100015361967 [1,0,1,0,0,0|2,0,0]=4 1112 B12R1.116 CCOc1ccc(cc1)CCBr 34a_100009816426_100000210202 [1,0,1,0,0,0|2,0,0]=4 1113 B12R1.116 CCOc1ccc(cc1)CCBr 7a_100009816426_100000210202 [1,0,1,0,0,0|2,0,0]=4 1114 B12R1.116 CCOc1ccc(cc1)CCN 34a_100000743037_100000210202 [1,0,1,0,0,0|1,0,0]=3 1115 B12R1.116 CCOc1ccc(cc1)CCO 34a_100011215338_100000210202 [1,0,1,0,0,0|2,0,0]=4 1116 B12R1.116 CCOc1ccc(cc1)CCO 7a_100011215338_100000210202 [1,0,1,0,0,0|2,0,0]=4 1117 B12R1.116 CCOc1ccc(cc1)CNC 207a_100102657272_100000169836 [1,0,1,0,0,0|2,0,0]=4 1118 B12R1.116 CCOc1ccc(cc1)CNC 2230a_100000185588_200000210301 [1,0,1,0,0,0|2,0,0]=4 1119 B12R1.116 CCOc1ccc(cc1)CNC 270004a_106832991635_100000169836 [1,0,1,0,0,0|2,0,0]=4 1120 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000185588_200000210301 [1,0,1,0,0,0|2,0,0]=4 1121 B12R1.116 CCOc1ccc(cc1)CNC 34a_100000207500_100000210202 [1,0,1,0,0,0|2,0,0]=4 1122 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 2230a_100000185588_200025704644 [1,0,1,0,0,0|2,0,0]=4 1123 B12R1.116 CCOc1ccc(cc1)CN[13CH3] 34a_100000185588_200025704644 [1,0,1,0,0,0|2,0,0]=4 1124 B12R1.116 CCOc1ccc(cc1)COC 34a_100000173027_200000210301 [1,0,1,0,0,0|2,0,0]=4 1125 B12R1.116 CCOc1ccc(cc1)COC 34a_200011995677_100000210202 [1,0,1,0,0,0|2,0,0]=4 1126 B12R1.116 CCOc1ccc(cc1)COC 7a_100000173027_200000210301 [1,0,1,0,0,0|2,0,0]=4 1127 B12R1.116 CCOc1ccc(cc1)COC 7a_200011995677_100000210202 [1,0,1,0,0,0|2,0,0]=4 1128 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 34a_100000173027_200025704644 [1,0,1,0,0,0|2,0,0]=4 1129 B12R1.116 CCOc1ccc(cc1)CO[13CH3] 7a_100000173027_200025704644 [1,0,1,0,0,0|2,0,0]=4 1130 B12R1.116 CCOc1ccc(cc1)OCC 34a_100000185467_100000210202 [1,0,1,0,0,0|2,0,0]=4 1131 B12R1.116 CCOc1ccc(cc1)OCF 34a_100000185467_100015361967 [1,0,1,0,0,0|2,0,0]=4 1132 B12R1.116 CCOc1ccc(cc1)SCC 62a_100000210202_100000171712 [1,0,1,0,0,0|2,0,0]=4 1133 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000210202_100000755846 [1,0,1,0,0,0|1,1,0]=4 1134 B12R1.116 CCSc1ccc(cc1)CCN 62a_100000755846_100000210202 [1,0,1,0,0,0|1,1,0]=4 1135 B12R1.116 CCSc1ccc(cc1)CCO 62a_100000210202_100000766406 [1,0,1,0,0,0|2,0,0]=4 1136 B12R1.116 CCSc1ccc(cc1)CCO 62a_100000766406_100000210202 [1,0,1,0,0,0|2,0,0]=4 1137 B12R1.116 CNCc1ccc(cc1)CCO 26a_100102657272_100011215338 [1,0,1,0,0,0|2,0,0]=4 1138 B12R1.116 CNCc1ccc(cc1)OCF 34a_100000207500_100015361967 [1,0,1,0,0,0|2,0,0]=4 1139 B12R1.116 COCc1ccc(cc1)OCF 34a_200011995677_100015361967 [1,0,1,0,0,0|2,0,0]=4 1140 B12R1.116 COCc1ccc(cc1)OCF 7a_200011995677_100015361967 [1,0,1,0,0,0|2,0,0]=4 1141 B12R1.116 FCOc1ccc(cc1)CCBr 34a_100009816426_100015361967 [1,0,1,0,0,0|2,0,0]=4 1142 B12R1.116 FCOc1ccc(cc1)CCBr 7a_100009816426_100015361967 [1,0,1,0,0,0|2,0,0]=4 1143 B12R1.116 NCCc1ccc(cc1)OCF 34a_100000743037_100015361967 [1,0,1,0,0,0|1,0,0]=3 1144 B12R1.116 NCCc1ccc(cc1)SCF 62a_100000755846_100015361967 [1,0,1,0,0,0|1,1,0]=4 1145 B12R1.116 NCCc1ccc(cc1)SCF 62a_100015361967_100000755846 [1,0,1,0,0,0|1,1,0]=4 1146 B12R1.116 OCCc1ccc(cc1)OCF 34a_100011215338_100015361967 [1,0,1,0,0,0|2,0,0]=4 1147 B12R1.116 OCCc1ccc(cc1)OCF 7a_100011215338_100015361967 [1,0,1,0,0,0|2,0,0]=4 1148 B12R1.278 CCCc1cccc(c1)OCC 34a_100000039106_100000210202 [1,0,1,0,0,0|1,0,0]=3 1149 B12R1.278 CCCc1cccc(c1)OCC 7a_100000039106_100000210202 [1,0,1,0,0,0|1,0,0]=3 1150 B12R1.278 CCCc1cccc(c1)OCF 34a_100000039106_100015361967 [1,0,1,0,0,0|1,0,0]=3 1151 B12R1.278 CCCc1cccc(c1)OCF 7a_100000039106_100015361967 [1,0,1,0,0,0|1,0,0]=3 1152 B12R1.278 CCCc1cccc(c1)SCC 62a_100000210202_100000694964 [1,0,1,0,0,0|1,1,0]=4 1153 B12R1.278 CCCc1cccc(c1)SCC 62a_100000694964_100000210202 [1,0,1,0,0,0|1,1,0]=4 1154 B12R1.278 CCCc1cccc(c1)SCF 62a_100000694964_100015361967 [1,0,1,0,0,0|1,1,0]=4 1155 B12R1.278 CCCc1cccc(c1)SCF 62a_100015361967_100000694964 [1,0,1,0,0,0|1,1,0]=4 1156 B12R1.278 CCNc1cccc(c1)CCO 2230a_100011996697_100000210202 [1,0,1,0,0,0|2,0,0]=4 1157 B12R1.278 CCNc1cccc(c1)CCO 34a_100011996697_100000210202 [1,0,1,0,0,0|2,0,0]=4 1158 B12R1.278 CCNc1cccc(c1)OCC 2230a_100000742568_100000210202 [1,0,1,0,0,0|2,0,0]=4 1159 B12R1.278 CCNc1cccc(c1)OCC 34a_100000717746_100000210202 [1,0,1,0,0,0|2,0,0]=4 1160 B12R1.278 CCNc1cccc(c1)OCC 34a_100000742568_100000210202 [1,0,1,0,0,0|2,0,0]=4 1161 B12R1.278 CCNc1cccc(c1)OCC 7a_100000717746_100000210202 [1,0,1,0,0,0|2,0,0]=4 1162 B12R1.278 CCNc1cccc(c1)OCF 34a_100000717746_100015361967 [1,0,1,0,0,0|2,0,0]=4 1163 B12R1.278 CCNc1cccc(c1)OCF 7a_100000717746_100015361967 [1,0,1,0,0,0|2,0,0]=4 1164 B12R1.278 CCOc1cccc(c1)CCN 34a_100000747277_100000210202 [1,0,1,0,0,0|1,0,0]=3 1165 B12R1.278 CCOc1cccc(c1)CCO 34a_100011215281_100000210202 [1,0,1,0,0,0|2,0,0]=4 1166 B12R1.278 CCOc1cccc(c1)CCO 7a_100011215281_100000210202 [1,0,1,0,0,0|2,0,0]=4 1167 B12R1.278 CCOc1cccc(c1)CNC 207a_100102657272_100000170239 [1,0,1,0,0,0|2,0,0]=4 1168 B12R1.278 CCOc1cccc(c1)CNC 2230a_106359896916_200000210301 [1,0,1,0,0,0|2,0,0]=4 1169 B12R1.278 CCOc1cccc(c1)CNC 270004a_106832991635_100000170239 [1,0,1,0,0,0|2,0,0]=4 1170 B12R1.278 CCOc1cccc(c1)CNC 34a_100000207540_100000210202 [1,0,1,0,0,0|2,0,0]=4 1171 B12R1.278 CCOc1cccc(c1)CNC 34a_106359896916_200000210301 [1,0,1,0,0,0|2,0,0]=4 1172 B12R1.278 CCOc1cccc(c1)CNN 34a_100000008902_100000210202 [1,0,1,0,0,0|2,0,0]=4 1173 B12R1.278 CCOc1cccc(c1)CN[13CH3] 2230a_106359896916_200025704644 [1,0,1,0,0,0|2,0,0]=4 1174 B12R1.278 CCOc1cccc(c1)CN[13CH3] 34a_106359896916_200025704644 [1,0,1,0,0,0|2,0,0]=4 1175 B12R1.278 CCOc1cccc(c1)COC 34a_200011232711_200000210301 [1,0,1,0,0,0|2,0,0]=4 1176 B12R1.278 CCOc1cccc(c1)COC 7a_200011232711_200000210301 [1,0,1,0,0,0|2,0,0]=4 1177 B12R1.278 CCOc1cccc(c1)CO[13CH3] 34a_200011232711_200025704644 [1,0,1,0,0,0|2,0,0]=4 1178 B12R1.278 CCOc1cccc(c1)CO[13CH3] 7a_200011232711_200025704644 [1,0,1,0,0,0|2,0,0]=4 1179 B12R1.278 CCOc1cccc(c1)OCC 34a_100011215941_100000210202 [1,0,1,0,0,0|2,0,0]=4 1180 B12R1.278 CCOc1cccc(c1)OCC 7a_100011215941_100000210202 [1,0,1,0,0,0|2,0,0]=4 1181 B12R1.278 CCOc1cccc(c1)OCF 34a_100011215941_100015361967 [1,0,1,0,0,0|2,0,0]=4 1182 B12R1.278 CCOc1cccc(c1)OCF 7a_100011215941_100015361967 [1,0,1,0,0,0|2,0,0]=4 1183 B12R1.278 CCOc1cccc(c1)SCC 62a_100000210202_100000170002 [1,0,1,0,0,0|2,0,0]=4 1184 B12R1.278 CCSc1cccc(c1)CCN 62a_100000210202_100011207229 [1,0,1,0,0,0|1,1,0]=4 1185 B12R1.278 CCSc1cccc(c1)CCN 62a_100011207229_100000210202 [1,0,1,0,0,0|1,1,0]=4 1186 B12R1.278 CCSc1cccc(c1)CCO 62a_100000210202_100011217444 [1,0,1,0,0,0|2,0,0]=4 1187 B12R1.278 CCSc1cccc(c1)CCO 62a_100011217444_100000210202 [1,0,1,0,0,0|2,0,0]=4 1188 B12R1.278 CNCc1cccc(c1)CCO 26a_100102657272_100011215281 [1,0,1,0,0,0|2,0,0]=4 1189 B12R1.278 CNCc1cccc(c1)OCF 34a_100000207540_100015361967 [1,0,1,0,0,0|2,0,0]=4 1190 B12R1.278 NCCc1cccc(c1)OCF 34a_100000747277_100015361967 [1,0,1,0,0,0|1,0,0]=3 1191 B12R1.278 NCCc1cccc(c1)SCF 62a_100011207229_100015361967 [1,0,1,0,0,0|1,1,0]=4 1192 B12R1.278 NCCc1cccc(c1)SCF 62a_100015361967_100011207229 [1,0,1,0,0,0|1,1,0]=4 1193 B12R1.278 NNCc1cccc(c1)OCF 34a_100000008902_100015361967 [1,0,1,0,0,0|2,0,0]=4 1194 B12R1.278 OCCc1cccc(c1)OCF 34a_100011215281_100015361967 [1,0,1,0,0,0|2,0,0]=4 1195 B12R1.278 OCCc1cccc(c1)OCF 7a_100011215281_100015361967 [1,0,1,0,0,0|2,0,0]=4 1196 B12R2.44 C=Cc1ccc2c(c1)OCO2 271570a_100011290941_100000688060 [2,0,0,0,0,0|0,0,2]=4 1197 B12R2.44 CNc1ccc2c(c1)CCO2 2230a_100000736984_200000210301 [2,0,0,0,0,0|2,0,0]=4 1198 B12R2.44 CNc1ccc2c(c1)CCO2 34a_100000736984_200000210301 [2,0,0,0,0,0|2,0,0]=4 1199 B12R2.44 CNc1ccc2c(c1)OCO2 2230a_100000209953_200000210301 [2,0,0,0,0,0|1,0,0]=3 1200 B12R2.44 CNc1ccc2c(c1)OCO2 34a_100000209953_200000210301 [2,0,0,0,0,0|1,0,0]=3 1201 B12R2.44 COc1ccc2c(c1)OCO2 34a_100000210298_200000210301 [2,0,0,0,0,0|1,0,0]=3 1202 B12R2.44 CSc1ccc2c(c1)CCO2 62a_100000729065_200000210301 [2,0,0,0,0,0|2,0,0]=4 1203 B12R2.44 CSc1ccc2c(c1)CCO2 62a_200000210301_100000729065 [2,0,0,0,0,0|2,0,0]=4 1204 B12R2.44 CSc1ccc2c(c1)OCC2 62a_100009818566_200000210301 [2,0,0,0,0,0|2,0,0]=4 1205 B12R2.44 CSc1ccc2c(c1)OCC2 62a_200000210301_100009818566 [2,0,0,0,0,0|2,0,0]=4 1206 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 2230a_100000736984_200025704644 [2,0,0,0,0,0|2,0,0]=4 1207 B12R2.44 [13CH3]Nc1ccc2c(c1)CCO2 34a_100000736984_200025704644 [2,0,0,0,0,0|2,0,0]=4 1208 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 2230a_100000209953_200025704644 [2,0,0,0,0,0|1,0,0]=3 1209 B12R2.44 [13CH3]Nc1ccc2c(c1)OCO2 34a_100000209953_200025704644 [2,0,0,0,0,0|1,0,0]=3 1210 B12R2.44 [13CH3]Oc1ccc2c(c1)OCO2 34a_100000210298_200025704644 [2,0,0,0,0,0|1,0,0]=3 1211 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_100000729065_200025704644 [2,0,0,0,0,0|2,0,0]=4 1212 B12R2.44 [13CH3]Sc1ccc2c(c1)CCO2 62a_200025704644_100000729065 [2,0,0,0,0,0|2,0,0]=4 1213 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_100009818566_200025704644 [2,0,0,0,0,0|2,0,0]=4 1214 B12R2.44 [13CH3]Sc1ccc2c(c1)OCC2 62a_200025704644_100009818566 [2,0,0,0,0,0|2,0,0]=4 1215 B14R1.3275 COc1ccc(cc1O)CC(F)(F)F 271570a_203496583355_200021545266 [0,1,1,0,0,0|2,0,0]=4 1216 B14R1.3275 COc1ccc(cc1O)NC(C)(C)C 34a_100000211920_100000210625 [0,1,1,0,0,0|2,0,0]=4 1217 B14R1.3275 COc1ccc(cc1O)SC(C)(C)C 62a_100000211941_100009816560 [0,1,1,0,0,0|2,0,0]=4 1218 B14R1.3276 C#CC(C)Nc1ccc(c(c1)O)OC 34a_100000211920_200000035995 [0,1,1,0,0,0|2,0,0]=4 1219 B14R1.3276 C#CC(C)Sc1ccc(c(c1)O)OC 62a_200000035995_100009816560 [0,1,1,0,0,0|2,0,0]=4 1220 B14R1.3276 C=CC(C)Sc1ccc(c(c1)O)OC 62a_100011215867_100009816560 [0,1,1,0,0,0|2,0,0]=4 1221 B14R1.3276 CCC(=O)Cc1ccc(c(c1)O)OC 1458a_100000049095_100000210202 [0,1,1,0,0,0|1,0,1]=4 1222 B14R1.3276 CCC(C)Nc1ccc(c(c1)O)OC 34a_100000211920_100011215416 [0,1,1,0,0,0|2,0,0]=4 1223 B14R1.3276 CCC(C)Sc1ccc(c(c1)O)OC 62a_100000758301_100009816560 [0,1,1,0,0,0|2,0,0]=4 1224 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 2230a_100000188468_100000210202 [0,1,1,0,0,0|2,0,0]=4 1225 B14R1.3276 CCN(C)Cc1ccc(c(c1)O)OC 269982a_100000188468_100000204670 [0,1,1,0,0,0|2,0,0]=4 1226 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 240690a_100102657272_100000049095 [0,1,1,0,0,0|1,0,1]=4 1227 B14R1.3276 CNC(=O)Cc1ccc(c(c1)O)OC 527a_100102657272_100000049095 [0,1,1,0,0,0|1,0,1]=4 1228 B14R1.3276 CNC(C)Cc1ccc(c(c1)Br)OC 270004a_106832991635_100011493462 [0,1,1,0,0,0|1,0,0]=3 1229 B14R1.3276 CNC(C)Cc1ccc(c(c1)Cl)OC 270004a_106832991635_200000078656 [0,1,1,0,0,0|1,0,0]=3 1230 B14R1.3276 COC(=O)Cc1ccc(c(c1)O)OC 271570a_203496583355_200012357789 [0,1,1,0,0,0|1,0,1]=4 1231 B14R1.3276 COc1ccc(cc1O)CC(=O)CF 1458a_100000049095_100015361967 [0,1,1,0,0,0|1,0,1]=4 1232 B14R1.3276 COc1ccc(cc1O)CN(C)CF 269982a_100000188468_100015361967 [0,1,1,0,0,0|2,0,0]=4 1233 B14R1.3276 COc1ccc(cc1O)NC(C)CO 34a_100000211920_100012180447 [0,1,1,0,0,0|2,0,0]=4 1234 B14R1.3276 COc1ccc(cc1O)SC(C)C#N 62a_100000703298_100009816560 [0,1,1,0,0,0|1,0,1]=4 1235 B14R1.3276 COc1ccc(cc1O)SC(C)CO 62a_100012180447_100009816560 [0,1,1,0,0,0|2,0,0]=4 1236 B14R1.3276 COc1ccc(cc1O)SC(C)OC 62a_100009879195_100009816560 [0,1,1,0,0,0|2,0,0]=4 1237 B14R1.3276 COc1ccc(cc1O)S[C@H](C)CO 62a_100016084084_100009816560 [0,1,1,0,0,0|2,0,0]=4 1238 B14R1.3651 COc1cc(ccc1O[13CH3])CC(=O)C 34a_200000039568_200025704644 [0,1,1,0,0,0|1,0,1]=4 1239 B14R1.3651 COc1ccc(cc1CO)CN(C)C 270004a_100102631434_100011361677 [0,1,1,0,0,0|2,0,0]=4 1240 B14R1.3651 COc1ccc(cc1CO)SC(C)C 62a_100000204679_100000210206 [0,1,1,0,0,0|2,0,0]=4 1241 B14R1.3651 COc1ccc(cc1CO)SC(C)C 62a_100000210206_100000204679 [0,1,1,0,0,0|2,0,0]=4 1242 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 1458a_100000184093_200000210301 [0,1,1,0,0,0|1,0,1]=4 1243 B14R1.3651 COc1ccc(cc1OC)CC(=O)C 34a_200000039568_200000210301 [0,1,1,0,0,0|1,0,1]=4 1244 B14R1.3651 COc1ccc(cc1OC)CC(=O)[13CH3] 1458a_100000184093_200025704644 [0,1,1,0,0,0|1,0,1]=4 1245 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100000180827_200000210301 [0,1,1,0,0,0|2,0,0]=4 1246 B14R1.3651 COc1ccc(cc1OC)CN(C)C 2230a_100102631434_100011233839 [0,1,1,0,0,0|2,0,0]=4 1247 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100000180827_200000210301 [0,1,1,0,0,0|2,0,0]=4 1248 B14R1.3651 COc1ccc(cc1OC)CN(C)C 269982a_100102631434_100011233839 [0,1,1,0,0,0|2,0,0]=4 1249 B14R1.3651 COc1ccc(cc1OC)CN(C)C 270004a_100102631434_100000170513 [0,1,1,0,0,0|2,0,0]=4 1250 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 2230a_100000180827_200025704644 [0,1,1,0,0,0|2,0,0]=4 1251 B14R1.3651 COc1ccc(cc1OC)CN(C)[13CH3] 269982a_100000180827_200025704644 [0,1,1,0,0,0|2,0,0]=4 1252 B14R1.3651 COc1ccc(cc1OC)NC(C)C 34a_100000187404_100000210206 [0,1,1,0,0,0|2,0,0]=4 1253 B14R1.3651 COc1ccc(cc1OC)OC(C)C 34a_100000039706_100000210206 [0,1,1,0,0,0|2,0,0]=4 1254 B14R1.3651 COc1ccc(cc1OC)SC(C)C 62a_100000210206_100011356967 [0,1,1,0,0,0|2,0,0]=4 1255 B14R1.3652 COc1ccc(cc1O)C(=O)C(C)C 1458a_100000766810_100000210206 [0,1,1,0,0,0|1,0,1]=4 1256 B14R1.12535 COc1c(cc(cc1Cl)CN(C)C)O 270004a_100102631434_200010620221 [0,1,1,0,0,0|2,0,0]=4 1257 B14R1.41 COc1cc(ccc1O)C(=O)C(C)C 1458a_100000687070_100000210206 [0,1,1,0,0,0|1,0,1]=4 1258 B14R1.41 COc1cc(ccc1O)C(O)C(=O)C 1458a_100000036414_200000210301 [0,1,1,0,0,0|1,0,1]=4 1259 B14R1.41 COc1cc(ccc1O)C(O)C(=O)[13CH3] 1458a_100000036414_200025704644 [0,1,1,0,0,0|1,0,1]=4 1260 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)C 1458a_100009814412_200000210301 [0,1,1,0,0,0|1,0,1]=4 1261 B14R1.343 COc1cc(cc(c1O)Br)CC(=O)[13CH3] 1458a_100009814412_200025704644 [0,1,1,0,0,0|1,0,1]=4 1262 B14R1.343 COc1cc(cc(c1O)O)SC(C)C 62a_100000210206_200159242197 [0,1,1,0,0,0|2,0,0]=4 1263 B14R1.439 CCOc1cc(ccc1O)CC(=O)C 1458a_200000048972_200000210301 [0,1,1,0,0,0|1,0,1]=4 1264 B14R1.439 CCOc1cc(ccc1O)CC(=O)[13CH3] 1458a_200000048972_200025704644 [0,1,1,0,0,0|1,0,1]=4 1265 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)C 1458a_100009814189_200000210301 [0,1,1,0,0,0|1,0,1]=4 1266 B14R1.881 COc1cc(c(cc1O)Br)CC(=O)[13CH3] 1458a_100009814189_200025704644 [0,1,1,0,0,0|1,0,1]=4 1267 B14R1.881 COc1cc(c(cc1O)F)SC(C)C 62a_100000210206_100010189133 [0,1,1,0,0,0|2,0,0]=4 1268 B14R1.3405 C#CC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_200000035995 [0,1,1,0,0,0|2,0,0]=4 1269 B14R1.3405 C#CC(C)Sc1ccc(c(c1)OC)O 62a_200000035995_100000694246 [0,1,1,0,0,0|2,0,0]=4 1270 B14R1.3405 C=CC(C)Sc1ccc(c(c1)OC)O 62a_100011215867_100000694246 [0,1,1,0,0,0|2,0,0]=4 1271 B14R1.3405 CCC(=O)Cc1ccc(c(c1)OC)O 1458a_100000032101_100000210202 [0,1,1,0,0,0|1,0,1]=4 1272 B14R1.3405 CCC(C)Nc1ccc(c(c1)OC)O 34a_100000726020_100011215416 [0,1,1,0,0,0|2,0,0]=4 1273 B14R1.3405 CCC(C)Sc1ccc(c(c1)OC)O 62a_100000758301_100000694246 [0,1,1,0,0,0|2,0,0]=4 1274 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 240690a_100102657272_100000032101 [0,1,1,0,0,0|1,0,1]=4 1275 B14R1.3405 CNC(=O)Cc1ccc(c(c1)OC)O 527a_100102657272_100000032101 [0,1,1,0,0,0|1,0,1]=4 1276 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)C 270004a_106832991635_200000081148 [0,1,1,0,0,0|1,0,0]=3 1277 B14R1.3405 CNC(C)Cc1ccc(c(c1)OC)F 270004a_106832991635_200000078651 [0,1,1,0,0,0|1,0,0]=3 1278 B14R1.3405 COc1cc(ccc1O)CC(=O)CF 1458a_100000032101_100015361967 [0,1,1,0,0,0|1,0,1]=4 1279 B14R1.3405 COc1cc(ccc1O)NC(C)CO 34a_100000726020_100012180447 [0,1,1,0,0,0|2,0,0]=4 1280 B14R1.3405 COc1cc(ccc1O)SC(C)C#N 62a_100000703298_100000694246 [0,1,1,0,0,0|1,0,1]=4 1281 B14R1.3405 COc1cc(ccc1O)SC(C)CO 62a_100012180447_100000694246 [0,1,1,0,0,0|2,0,0]=4 1282 B14R1.3405 COc1cc(ccc1O)SC(C)OC 62a_100009879195_100000694246 [0,1,1,0,0,0|2,0,0]=4 1283 B14R1.3405 COc1cc(ccc1O)S[C@H](C)CO 62a_100016084084_100000694246 [0,1,1,0,0,0|2,0,0]=4 1284 B14R1.3412 COc1cc(ccc1O)NC(C)(C)C 34a_100000726020_100000210625 [0,1,1,0,0,0|2,0,0]=4 1285 B14R1.3412 COc1cc(ccc1O)SC(C)(C)C 62a_100000211941_100000694246 [0,1,1,0,0,0|2,0,0]=4 1286 B14R1.24 CCOc1ccc(cc1)CC(C)NC 270004a_106832991635_200011996056 [0,1,1,0,0,0|1,0,0]=3 1287 B14R1.24 CCOc1ccc(cc1)C[C@@H](N)CO 34a_100020629837_100000210202 [0,1,1,0,0,0|1,0,0]=3 1288 B14R1.24 N[C@@H](CO)Cc1ccc(cc1)OCF 34a_100020629837_100015361967 [0,1,1,0,0,0|1,0,0]=3 1289 B14R1.68 C#CCOc1ccc(cc1)CC(C)N 34a_100102634573_100000184674 [0,1,1,0,0,0|1,0,0]=3 1290 B14R1.68 C=CCOc1ccc(cc1)CC(C)N 34a_100102634573_100015514636 [0,1,1,0,0,0|1,0,0]=3 1291 B14R1.68 CC(=O)Cc1ccc(cc1)OCCO 34a_100011218180_100000211926 [0,1,1,0,0,0|1,0,1]=4 1292 B14R1.68 CC(=O)Cc1ccc(cc1)OCCO 7a_100011218180_100000211926 [0,1,1,0,0,0|1,0,1]=4 1293 B14R1.68 CC(C)Cc1ccc(cc1)COCF 34a_200011266444_100015361967 [0,1,1,0,0,0|2,0,0]=4 1294 B14R1.68 CC(C)Cc1ccc(cc1)COCF 7a_200011266444_100015361967 [0,1,1,0,0,0|2,0,0]=4 1295 B14R1.68 CC(C)Cc1ccc(cc1)NCCO 2230a_100000687309_100000211926 [0,1,1,0,0,0|2,0,0]=4 1296 B14R1.68 CC(C)Cc1ccc(cc1)NCCO 34a_100000687309_100000211926 [0,1,1,0,0,0|2,0,0]=4 1297 B14R1.68 CC(C)Cc1ccc(cc1)SCCO 62a_100000211926_100011221366 [0,1,1,0,0,0|1,1,0]=4 1298 B14R1.68 CC(C)Cc1ccc(cc1)SCCO 62a_100011221366_100000211926 [0,1,1,0,0,0|1,1,0]=4 1299 B14R1.68 CC(C)Nc1ccc(cc1)OCCO 2230a_100000754363_100000210206 [0,1,1,0,0,0|2,0,0]=4 1300 B14R1.68 CC(C)Nc1ccc(cc1)OCCO 34a_100000754363_100000210206 [0,1,1,0,0,0|2,0,0]=4 1301 B14R1.68 CC(C)Oc1ccc(cc1)OCCO 34a_100000757185_100000211926 [0,1,1,0,0,0|2,0,0]=4 1302 B14R1.68 CC(C)Oc1ccc(cc1)OCCO 7a_100000757185_100000211926 [0,1,1,0,0,0|2,0,0]=4 1303 B14R1.68 CC(C)Sc1ccc(cc1)OCCO 62a_100000210206_100000686261 [0,1,1,0,0,0|2,0,0]=4 1304 B14R1.68 CC(C)Sc1ccc(cc1)OCCO 62a_100000686261_100000210206 [0,1,1,0,0,0|2,0,0]=4 1305 B14R1.68 CC(N)Cc1ccc(cc1)OCC=O 34a_100102634573_200009817547 [0,1,1,0,0,0|0,0,1]=3 1306 B14R1.68 CC(N)Cc1ccc(cc1)OCCF 34a_100102634573_100011217306 [0,1,1,0,0,0|1,0,0]=3 1307 B14R1.68 CC(N)Cc1ccc(cc1)OCCO 34a_100102634573_100000211926 [0,1,1,0,0,0|0,0,0]=2 1308 B14R1.68 CCCOc1ccc(cc1)CC(C)N 34a_100102634573_100000210303 [0,1,1,0,0,0|1,0,0]=3 1309 B14R1.68 CCOCc1ccc(cc1)CC(C)C 34a_100121572206_100011982790 [0,1,1,0,0,0|2,0,0]=4 1310 B14R1.68 CCOCc1ccc(cc1)CC(C)C 34a_200011266444_100000210202 [0,1,1,0,0,0|2,0,0]=4 1311 B14R1.68 CCOCc1ccc(cc1)CC(C)C 7a_200011266444_100000210202 [0,1,1,0,0,0|2,0,0]=4 1312 B14R1.68 CN(C)Cc1ccc(cc1)OCCO 270004a_100102631434_100011219967 [0,1,1,0,0,0|2,0,0]=4 1313 B14R1.68 COCNc1ccc(cc1)CC(C)C 2230a_100000687309_100000766300 [0,1,1,0,0,0|2,0,0]=4 1314 B14R1.68 COCOc1ccc(cc1)OC(C)C 34a_200012265912_100000210206 [0,1,1,0,0,0|2,0,0]=4 1315 B14R1.68 COCOc1ccc(cc1)SC(C)C 62a_100000210206_100012265687 [0,1,1,0,0,0|2,0,0]=4 1316 B14R1.68 COCOc1ccc(cc1)SC(C)C 62a_100012265687_100000210206 [0,1,1,0,0,0|2,0,0]=4 1317 B14R1.68 COCSc1ccc(cc1)CC(C)C 62a_100000766300_100011221366 [0,1,1,0,0,0|1,1,0]=4 1318 B14R1.68 COCSc1ccc(cc1)CC(C)C 62a_100011221366_100000766300 [0,1,1,0,0,0|1,1,0]=4 1319 B14R1.68 CSCOc1ccc(cc1)CC(C)N 34a_100102634573_100011218213 [0,1,1,0,0,0|0,1,0]=3 1320 B14R1.68 NC(=O)Cc1ccc(cc1)OCCO 34a_100000020825_100000211926 [0,1,1,0,0,0|1,0,1]=4 1321 B14R1.805 CC(N)Cc1ccc(cc1)OC(C)C 34a_100102634573_100000210206 [0,1,1,0,0,0|1,0,0]=3 1322 B14R1.470 CCOc1cccc(c1)CC(C)NC 270004a_106832991635_200000077187 [0,1,1,0,0,0|1,0,0]=3 1323 B14R1.470 CCSc1cccc(c1)CC(N)CO 62a_100000210202_114802770106 [0,1,1,0,0,0|1,1,0]=4 1324 B14R1.470 CCSc1cccc(c1)CC(N)CO 62a_114802770106_100000210202 [0,1,1,0,0,0|1,1,0]=4 1325 B14R1.470 NC(CO)Cc1cccc(c1)SCF 62a_100015361967_114802770106 [0,1,1,0,0,0|1,1,0]=4 1326 B14R1.470 NC(CO)Cc1cccc(c1)SCF 62a_114802770106_100015361967 [0,1,1,0,0,0|1,1,0]=4 1327 B14R1.778 CC(C)Cc1cccc(c1)SCCO 62a_100000211926_100010883412 [0,1,1,0,0,0|1,1,0]=4 1328 B14R1.778 CC(C)Cc1cccc(c1)SCCO 62a_100010883412_100000211926 [0,1,1,0,0,0|1,1,0]=4 1329 B14R1.778 CC(C)Nc1cccc(c1)OCCO 2230a_100011232151_100000210206 [0,1,1,0,0,0|2,0,0]=4 1330 B14R1.778 CC(C)Nc1cccc(c1)OCCO 34a_100011232151_100000210206 [0,1,1,0,0,0|2,0,0]=4 1331 B14R1.778 CC(C)Oc1cccc(c1)OCCO 34a_100000753242_100000211926 [0,1,1,0,0,0|2,0,0]=4 1332 B14R1.778 CC(C)Oc1cccc(c1)OCCO 7a_100000753242_100000211926 [0,1,1,0,0,0|2,0,0]=4 1333 B14R1.778 CC(C)Sc1cccc(c1)OCCO 62a_100000210206_100000757546 [0,1,1,0,0,0|2,0,0]=4 1334 B14R1.778 CC(C)Sc1cccc(c1)OCCO 62a_100000757546_100000210206 [0,1,1,0,0,0|2,0,0]=4 1335 B14R1.778 CN(C)Cc1cccc(c1)OCCO 270004a_100102631434_100011217509 [0,1,1,0,0,0|2,0,0]=4 1336 B14R1.778 COCOc1cccc(c1)CN(C)C 270004a_100102631434_200011361672 [0,1,1,0,0,0|2,0,0]=4 1337 B14R1.778 COCOc1cccc(c1)NC(C)C 34a_100012265470_100000210206 [0,1,1,0,0,0|2,0,0]=4 1338 B14R1.778 COCOc1cccc(c1)SC(C)C 62a_100000210206_100012265688 [0,1,1,0,0,0|2,0,0]=4 1339 B14R1.778 COCOc1cccc(c1)SC(C)C 62a_100012265688_100000210206 [0,1,1,0,0,0|2,0,0]=4 1340 B14R1.778 COCSc1cccc(c1)CC(C)C 62a_100000766300_100010883412 [0,1,1,0,0,0|1,1,0]=4 1341 B14R1.778 COCSc1cccc(c1)CC(C)C 62a_100010883412_100000766300 [0,1,1,0,0,0|1,1,0]=4 1342 B14R1.778 NC(=O)Cc1cccc(c1)OCCO 34a_200000747573_100000211926 [0,1,1,0,0,0|1,0,1]=4 1343 B14R1.778 NC(=O)Cc1cccc(c1)OCCO 7a_200000747573_100000211926 [0,1,1,0,0,0|1,0,1]=4 1344 B14R2.475 CCSc1ccc2c(c1)C(=O)CO2 62a_100000210202_100000752586 [1,1,0,0,0,0|2,0,0]=4 1345 B14R2.583 CC=Cc1cc2c(cc1N)OCO2 271570a_100016259895_100012557033 [1,1,0,0,0,0|0,0,2]=4 1346 B14R2.583 CC=Cc1cc2c(cc1O)OCO2 271570a_100016259895_100010290809 [1,1,0,0,0,0|0,0,2]=4 1347 B14R2.583 CCNc1cc2c(cc1C)OCO2 2230a_100000066439_100000210202 [1,1,0,0,0,0|1,0,0]=3 1348 B14R2.583 CCNc1cc2c(cc1C)OCO2 34a_100000066439_100000210202 [1,1,0,0,0,0|1,0,0]=3 1349 B14R2.583 CCNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210202 [1,1,0,0,0,0|1,0,0]=3 1350 B14R2.583 CCOc1cc2c(cc1Br)OCO2 34a_100010290809_100000210202 [1,1,0,0,0,0|1,0,0]=3 1351 B14R2.583 CCOc1cc2c(cc1Br)OCO2 7a_100010290809_100000210202 [1,1,0,0,0,0|1,0,0]=3 1352 B14R2.583 CCOc1cc2c(cc1C)OCO2 34a_100000145572_100000210202 [1,1,0,0,0,0|1,0,0]=3 1353 B14R2.583 CCOc1cc2c(cc1C)OCO2 7a_100000145572_100000210202 [1,1,0,0,0,0|1,0,0]=3 1354 B14R2.583 CCSc1cc2c(cc1N)OCO2 62a_100012557033_100000210202 [1,1,0,0,0,0|1,0,0]=3 1355 B14R2.583 CNCc1cc2c(cc1Br)OCO2 2230a_106832991635_100009995336 [1,1,0,0,0,0|1,0,0]=3 1356 B14R2.583 CNCc1cc2c(cc1Br)OCO2 2230a_200011199097_200000210301 [1,1,0,0,0,0|1,0,0]=3 1357 B14R2.583 CNCc1cc2c(cc1Br)OCO2 26a_100102657272_100010290809 [1,1,0,0,0,0|1,0,0]=3 1358 B14R2.583 CNCc1cc2c(cc1Br)OCO2 270004a_106832991635_100000186749 [1,1,0,0,0,0|1,0,0]=3 1359 B14R2.583 CNCc1cc2c(cc1Br)OCO2 34a_100102657272_100009995336 [1,1,0,0,0,0|1,0,0]=3 1360 B14R2.583 CNCc1cc2c(cc1Br)OCO2 7a_106832991635_100009995336 [1,1,0,0,0,0|1,0,0]=3 1361 B14R2.583 CNCc1cc2c(cc1C)OCO2 7a_106832991635_200000112958 [1,1,0,0,0,0|1,0,0]=3 1362 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 207a_100102657272_100000015535 [1,1,0,0,0,0|1,0,0]=3 1363 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 270004a_106832991635_100000015535 [1,1,0,0,0,0|1,0,0]=3 1364 B14R2.583 CNCc1cc2c(cc1Cl)OCO2 7a_106832991635_100000043460 [1,1,0,0,0,0|1,0,0]=3 1365 B14R2.583 COCc1cc2c(cc1Br)OCO2 34a_100000187691_200000210301 [1,1,0,0,0,0|1,0,0]=3 1366 B14R2.583 COCc1cc2c(cc1Br)OCO2 34a_100138415774_100009995336 [1,1,0,0,0,0|1,0,0]=3 1367 B14R2.583 COCc1cc2c(cc1Br)OCO2 7a_100000187691_200000210301 [1,1,0,0,0,0|1,0,0]=3 1368 B14R2.583 COCc1cc2c(cc1Cl)OCO2 34a_200000238738_200000210301 [1,1,0,0,0,0|1,0,0]=3 1369 B14R2.583 COCc1cc2c(cc1Cl)OCO2 7a_200000238738_200000210301 [1,1,0,0,0,0|1,0,0]=3 1370 B14R2.583 CSCc1cc2c(cc1Br)OCO2 62a_100009995336_200000210301 [1,1,0,0,0,0|1,0,0]=3 1371 B14R2.583 CSCc1cc2c(cc1Cl)OCO2 62a_100000043460_200000210301 [1,1,0,0,0,0|1,0,0]=3 1372 B14R2.583 Cc1cc2c(cc1NCF)OCO2 34a_100000066439_100015361967 [1,1,0,0,0,0|2,0,0]=4 1373 B14R2.583 Cc1cc2c(cc1OCF)OCO2 34a_100000145572_100015361967 [1,1,0,0,0,0|2,0,0]=4 1374 B14R2.583 Cc1cc2c(cc1OCF)OCO2 7a_100000145572_100015361967 [1,1,0,0,0,0|2,0,0]=4 1375 B14R2.583 FCNc1cc2c(cc1Cl)OCO2 34a_100000234339_100015361967 [1,1,0,0,0,0|2,0,0]=4 1376 B14R2.583 FCOc1cc2c(cc1Br)OCO2 34a_100010290809_100015361967 [1,1,0,0,0,0|2,0,0]=4 1377 B14R2.583 FCOc1cc2c(cc1Br)OCO2 7a_100010290809_100015361967 [1,1,0,0,0,0|2,0,0]=4 1378 B14R2.583 Nc1cc2c(cc1SCF)OCO2 62a_100012557033_100015361967 [1,1,0,0,0,0|2,0,0]=4 1379 B14R2.583 [13CH3]NCc1cc2c(cc1Br)OCO2 2230a_200011199097_200025704644 [1,1,0,0,0,0|1,0,0]=3 1380 B14R2.583 [13CH3]OCc1cc2c(cc1Br)OCO2 34a_100000187691_200025704644 [1,1,0,0,0,0|1,0,0]=3 1381 B14R2.583 [13CH3]OCc1cc2c(cc1Br)OCO2 7a_100000187691_200025704644 [1,1,0,0,0,0|1,0,0]=3 1382 B14R2.583 [13CH3]OCc1cc2c(cc1Cl)OCO2 34a_200000238738_200025704644 [1,1,0,0,0,0|1,0,0]=3 1383 B14R2.583 [13CH3]OCc1cc2c(cc1Cl)OCO2 7a_200000238738_200025704644 [1,1,0,0,0,0|1,0,0]=3 1384 B14R2.583 [13CH3]SCc1cc2c(cc1Br)OCO2 62a_100009995336_200025704644 [1,1,0,0,0,0|1,0,0]=3 1385 B14R2.583 [13CH3]SCc1cc2c(cc1Cl)OCO2 62a_100000043460_200025704644 [1,1,0,0,0,0|1,0,0]=3 1386 B14R2.587 CNCc1cc(c2c(c1)CCO2)Br 207a_100102657272_100009816904 [1,1,0,0,0,0|2,0,0]=4 1387 B14R2.587 CNCc1cc(c2c(c1)CCO2)Br 270004a_106832991635_100009816904 [1,1,0,0,0,0|2,0,0]=4 1388 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 207a_100102657272_100000682445 [1,1,0,0,0,0|1,0,0]=3 1389 B14R2.587 CNCc1cc(c2c(c1)OCO2)Br 270004a_106832991635_100000682445 [1,1,0,0,0,0|1,0,0]=3 1390 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 207a_100102657272_100000016197 [1,1,0,0,0,0|1,0,0]=3 1391 B14R2.587 CNCc1cc(c2c(c1)OCO2)Cl 270004a_106832991635_100000016197 [1,1,0,0,0,0|1,0,0]=3 1392 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200000210301 [1,1,0,0,0,0|1,0,0]=3 1393 B14R2.587 COCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200000210301 [1,1,0,0,0,0|1,0,0]=3 1394 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_200025704644 [1,1,0,0,0,0|1,0,0]=3 1395 B14R2.587 [13CH3]OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_200025704644 [1,1,0,0,0,0|1,0,0]=3 1396 B14R2.808 CC=Cc1ccc2c(c1C)OCO2 271570a_100016259895_100010335860 [1,1,0,0,0,0|0,0,2]=4 1397 B14R2.808 CC=Cc1ccc2c(c1F)OCO2 271570a_100016259895_100010223184 [1,1,0,0,0,0|0,0,2]=4 1398 B14R2.808 CCSc1ccc2c(c1C)OCO2 62a_100010335860_100000210202 [1,1,0,0,0,0|1,0,0]=3 1399 B14R2.808 CCSc1ccc2c(c1F)OCO2 62a_100010223184_100000210202 [1,1,0,0,0,0|1,0,0]=3 1400 B14R2.808 Cc1c(ccc2c1OCO2)SCF 62a_100010335860_100015361967 [1,1,0,0,0,0|2,0,0]=4 1401 B14R2.808 FCSc1ccc2c(c1F)OCO2 62a_100010223184_100015361967 [1,1,0,0,0,0|2,0,0]=4 1402 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 2230a_100159266031_200025704644 [1,1,0,0,0,0|2,0,0]=4 1403 B14R2.966 CC(N[13CH3])c1ccc2c(c1)CCO2 34a_100159266031_200025704644 [1,1,0,0,0,0|2,0,0]=4 1404 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 34a_100000741967_200025704644 [1,1,0,0,0,0|1,0,0]=3 1405 B14R2.966 CC(O[13CH3])c1ccc2c(c1)OCO2 7a_100000741967_200025704644 [1,1,0,0,0,0|1,0,0]=3 1406 B14R2.966 CCC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210202 [1,1,0,0,0,0|1,0,1]=4 1407 B14R2.966 CCC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210202 [1,1,0,0,0,0|0,0,1]=3 1408 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 2230a_200000219546_200000210301 [1,1,0,0,0,0|1,0,0]=3 1409 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 269982a_200000219546_200000210301 [1,1,0,0,0,0|1,0,0]=3 1410 B14R2.966 CCN(C)c1ccc2c(c1)OCO2 34a_200000219546_200000210301 [1,1,0,0,0,0|1,0,0]=3 1411 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 2230a_200000219546_200025704644 [1,1,0,0,0,0|1,0,0]=3 1412 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 269982a_200000219546_200025704644 [1,1,0,0,0,0|1,0,0]=3 1413 B14R2.966 CCN([13CH3])c1ccc2c(c1)OCO2 34a_200000219546_200025704644 [1,1,0,0,0,0|1,0,0]=3 1414 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 11a_106832991635_100000210863 [1,1,0,0,0,0|1,0,1]=4 1415 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 1626a_100102657272_100000210863 [1,1,0,0,0,0|1,0,1]=4 1416 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 240690a_100102657272_100000210863 [1,1,0,0,0,0|1,0,1]=4 1417 B14R2.966 CNC(=O)c1ccc2c(c1)OCO2 527a_100102657272_100000210863 [1,1,0,0,0,0|1,0,1]=4 1418 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 2230a_100159266031_200000210301 [1,1,0,0,0,0|2,0,0]=4 1419 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 269862a_106832991636_100000241315 [1,1,0,0,0,0|2,0,0]=4 1420 B14R2.966 CNC(C)c1ccc2c(c1)CCO2 34a_100159266031_200000210301 [1,1,0,0,0,0|2,0,0]=4 1421 B14R2.966 CNC(C)c1ccc2c(c1)OCC2 269862a_106832991636_100000143635 [1,1,0,0,0,0|2,0,0]=4 1422 B14R2.966 CNC(C)c1ccc2c(c1)OCO2 269862a_106832991636_100000211065 [1,1,0,0,0,0|1,0,0]=3 1423 B14R2.966 CN[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_200000210301 [1,1,0,0,0,0|1,0,0]=3 1424 B14R2.966 COC(C)c1ccc2c(c1)OCO2 34a_100000741967_200000210301 [1,1,0,0,0,0|1,0,0]=3 1425 B14R2.966 COC(C)c1ccc2c(c1)OCO2 7a_100000741967_200000210301 [1,1,0,0,0,0|1,0,0]=3 1426 B14R2.966 C[C@@H](N[13CH3])c1ccc2c(c1)OCO2 2230a_100000744171_200025704644 [1,1,0,0,0,0|1,0,0]=3 1427 B14R2.966 O=C(CF)c1ccc2c(c1)OCO2 1458a_100000210863_100015361967 [1,1,0,0,0,0|1,0,1]=4 1428 B14R2.991 C#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000038162 [1,1,0,0,0,0|0,0,2]=4 1429 B14R2.991 C#CCNc1ccc2c(c1)OCO2 34a_100000209953_100000184674 [1,1,0,0,0,0|0,0,2]=4 1430 B14R2.991 C#CCOc1ccc2c(c1)OCO2 34a_100000210298_100000184674 [1,1,0,0,0,0|0,0,2]=4 1431 B14R2.991 C=CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210623 [1,1,0,0,0,0|0,0,2]=4 1432 B14R2.991 C=CCNc1ccc2c(c1)OCO2 34a_100000209953_100015514636 [1,1,0,0,0,0|0,0,2]=4 1433 B14R2.991 C=CCOc1ccc2c(c1)OCO2 34a_100000210298_100015514636 [1,1,0,0,0,0|0,0,2]=4 1434 B14R2.991 CCCCc1cc2c(cn1)OCC2 271570a_100020621405_102495363667 [1,1,0,0,0,0|2,0,0]=4 1435 B14R2.991 CCCCc1ccc2c(c1)CCC2 271570a_100020621405_100000745594 [1,1,0,0,0,0|2,0,0]=4 1436 B14R2.991 CCCCc1ccc2c(c1)CCN2 271570a_100020621405_100000026929 [1,1,0,0,0,0|2,0,0]=4 1437 B14R2.991 CCCCc1ccc2c(c1)CCO2 271570a_100020621405_100000729065 [1,1,0,0,0,0|1,0,0]=3 1438 B14R2.991 CCCCc1ccc2c(c1)NCC2 271570a_100020621405_100000754641 [1,1,0,0,0,0|2,0,0]=4 1439 B14R2.991 CCCCc1ccc2c(c1)OCC2 271570a_100020621405_100009818566 [1,1,0,0,0,0|1,0,0]=3 1440 B14R2.991 CCCCc1ccc2c(c1)OCO2 271570a_100020621405_100000688060 [1,1,0,0,0,0|0,0,0]=2 1441 B14R2.991 CCCCc1ccc2ccoc2c1 271570a_100020621405_100000759542 [1,1,0,0,0,0|1,0,1]=4 1442 B14R2.991 CCCCc1ccc2cnoc2c1 271570a_100020621405_100009817722 [1,1,0,0,0,0|2,0,0]=4 1443 B14R2.991 CCCCc1ccc2ncoc2c1 271570a_100020621405_100009817590 [1,1,0,0,0,0|1,0,1]=4 1444 B14R2.991 CCCCc1ccc2occc2c1 271570a_100020621405_100012343831 [1,1,0,0,0,0|1,0,1]=4 1445 B14R2.991 CCCCc1ccc2ocnc2c1 271570a_100020621405_100009816175 [1,1,0,0,0,0|1,0,1]=4 1446 B14R2.991 CCCCc1ccc2oncc2c1 271570a_100020621405_100009817723 [1,1,0,0,0,0|2,0,0]=4 1447 B14R2.991 CCCNc1ccc2c(c1)CCC2 2230a_100000211504_100000210303 [1,1,0,0,0,0|2,0,0]=4 1448 B14R2.991 CCCNc1ccc2c(c1)CCC2 34a_100000211504_100000210303 [1,1,0,0,0,0|2,0,0]=4 1449 B14R2.991 CCCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210303 [1,1,0,0,0,0|1,0,0]=3 1450 B14R2.991 CCCNc1ccc2c(c1)CCO2 34a_100000736984_100000210303 [1,1,0,0,0,0|1,0,0]=3 1451 B14R2.991 CCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210303 [1,1,0,0,0,0|0,0,0]=2 1452 B14R2.991 CCCNc1ccc2c(c1)OCO2 34a_100000209953_100000210303 [1,1,0,0,0,0|0,0,0]=2 1453 B14R2.991 CCCNc1ccc2ccoc2c1 34a_100000102395_100000210303 [1,1,0,0,0,0|1,0,1]=4 1454 B14R2.991 CCCNc1ccc2cnoc2c1 34a_100000084182_100000210303 [1,1,0,0,0,0|2,0,0]=4 1455 B14R2.991 CCCNc1ccc2ncoc2c1 34a_100011248239_100000210303 [1,1,0,0,0,0|1,0,1]=4 1456 B14R2.991 CCCNc1ccc2occc2c1 34a_106430523501_100000210303 [1,1,0,0,0,0|1,0,1]=4 1457 B14R2.991 CCCNc1ccc2ocnc2c1 34a_100011219863_100000210303 [1,1,0,0,0,0|1,0,1]=4 1458 B14R2.991 CCCNc1ccc2oncc2c1 34a_100000037595_100000210303 [1,1,0,0,0,0|2,0,0]=4 1459 B14R2.991 CCCOc1ccc2c(c1)CCC2 34a_100000209987_100000210303 [1,1,0,0,0,0|2,0,0]=4 1460 B14R2.991 CCCOc1ccc2c(c1)CCC2 7a_100000209987_100000210303 [1,1,0,0,0,0|2,0,0]=4 1461 B14R2.991 CCCOc1ccc2c(c1)CCN2 34a_100020636429_100000210303 [1,1,0,0,0,0|2,0,0]=4 1462 B14R2.991 CCCOc1ccc2c(c1)NCC2 34a_100020636427_100000210303 [1,1,0,0,0,0|2,0,0]=4 1463 B14R2.991 CCCOc1ccc2c(c1)OCO2 34a_100000210298_100000210303 [1,1,0,0,0,0|0,0,0]=2 1464 B14R2.991 CCCOc1ccc2ccoc2c1 34a_100000089557_100000210303 [1,1,0,0,0,0|1,0,1]=4 1465 B14R2.991 CCCOc1ccc2ccoc2c1 7a_100000089557_100000210303 [1,1,0,0,0,0|1,0,1]=4 1466 B14R2.991 CCCOc1ccc2cnoc2c1 34a_100000098417_100000210303 [1,1,0,0,0,0|2,0,0]=4 1467 B14R2.991 CCCOc1ccc2cnoc2c1 7a_100000098417_100000210303 [1,1,0,0,0,0|2,0,0]=4 1468 B14R2.991 CCCOc1ccc2occc2c1 34a_100000070125_100000210303 [1,1,0,0,0,0|1,0,1]=4 1469 B14R2.991 CCCOc1ccc2occc2c1 7a_100000070125_100000210303 [1,1,0,0,0,0|1,0,1]=4 1470 B14R2.991 CCCSc1cc2c(cn1)OCC2 62a_100000210303_102495363667 [1,1,0,0,0,0|2,0,0]=4 1471 B14R2.991 CCCSc1cc2c(cn1)OCC2 62a_102495363667_100000210303 [1,1,0,0,0,0|2,0,0]=4 1472 B14R2.991 CCCSc1ccc2c(c1)CCC2 62a_100000210303_100000745594 [1,1,0,0,0,0|2,0,0]=4 1473 B14R2.991 CCCSc1ccc2c(c1)CCC2 62a_100000745594_100000210303 [1,1,0,0,0,0|2,0,0]=4 1474 B14R2.991 CCCSc1ccc2c(c1)CCN2 62a_100000210303_100000691068 [1,1,0,0,0,0|2,0,0]=4 1475 B14R2.991 CCCSc1ccc2c(c1)CCN2 62a_100000691068_100000210303 [1,1,0,0,0,0|2,0,0]=4 1476 B14R2.991 CCCSc1ccc2c(c1)CCO2 62a_100000210303_100000729065 [1,1,0,0,0,0|1,0,0]=3 1477 B14R2.991 CCCSc1ccc2c(c1)CCO2 62a_100000729065_100000210303 [1,1,0,0,0,0|1,0,0]=3 1478 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000210303_100000754641 [1,1,0,0,0,0|2,0,0]=4 1479 B14R2.991 CCCSc1ccc2c(c1)NCC2 62a_100000754641_100000210303 [1,1,0,0,0,0|2,0,0]=4 1480 B14R2.991 CCCSc1ccc2c(c1)OCC2 62a_100000210303_100009818566 [1,1,0,0,0,0|1,0,0]=3 1481 B14R2.991 CCCSc1ccc2c(c1)OCC2 62a_100009818566_100000210303 [1,1,0,0,0,0|1,0,0]=3 1482 B14R2.991 CCCSc1ccc2ccoc2c1 62a_100000210303_100000759542 [1,1,0,0,0,0|1,0,1]=4 1483 B14R2.991 CCCSc1ccc2cnoc2c1 62a_100000210303_100009817722 [1,1,0,0,0,0|2,0,0]=4 1484 B14R2.991 CCCSc1ccc2ncoc2c1 62a_100000210303_100009817590 [1,1,0,0,0,0|1,0,1]=4 1485 B14R2.991 CCCSc1ccc2occc2c1 62a_100000210303_100000691453 [1,1,0,0,0,0|1,0,1]=4 1486 B14R2.991 CCCSc1ccc2ocnc2c1 62a_100000210303_100009816175 [1,1,0,0,0,0|1,0,1]=4 1487 B14R2.991 CCCSc1ccc2oncc2c1 62a_100000210303_100009817723 [1,1,0,0,0,0|2,0,0]=4 1488 B14R2.991 CCNCc1ccc2c(c1)CCC2 207a_100015525214_100000765347 [1,1,0,0,0,0|2,0,0]=4 1489 B14R2.991 CCNCc1ccc2c(c1)CCC2 270004a_100015525214_100000765347 [1,1,0,0,0,0|2,0,0]=4 1490 B14R2.991 CCNCc1ccc2c(c1)CCO2 207a_100015525214_100011218456 [1,1,0,0,0,0|1,0,0]=3 1491 B14R2.991 CCNCc1ccc2c(c1)CCO2 2230a_100011219410_100000210202 [1,1,0,0,0,0|1,0,0]=3 1492 B14R2.991 CCNCc1ccc2c(c1)CCO2 270004a_100015525214_100011218456 [1,1,0,0,0,0|1,0,0]=3 1493 B14R2.991 CCNCc1ccc2c(c1)CCO2 34a_100011219410_100000210202 [1,1,0,0,0,0|1,0,0]=3 1494 B14R2.991 CCNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210202 [1,1,0,0,0,0|0,0,0]=2 1495 B14R2.991 CCNCc1ccc2c(c1)OCO2 34a_100000210006_100000210202 [1,1,0,0,0,0|0,0,0]=2 1496 B14R2.991 CCNCc1ccc2ncoc2c1 207a_100015525214_100000059852 [1,1,0,0,0,0|1,0,1]=4 1497 B14R2.991 CCNCc1ccc2ncoc2c1 2230a_100015525214_106359897996 [1,1,0,0,0,0|1,0,1]=4 1498 B14R2.991 CCNCc1ccc2ncoc2c1 270004a_100015525214_100000059852 [1,1,0,0,0,0|1,0,1]=4 1499 B14R2.991 CCNCc1ccc2occc2c1 207a_100015525214_100000040644 [1,1,0,0,0,0|1,0,1]=4 1500 B14R2.991 CCNCc1ccc2occc2c1 2230a_100020591328_100000210202 [1,1,0,0,0,0|1,0,1]=4 1501 B14R2.991 CCNCc1ccc2occc2c1 270004a_100015525214_100000040644 [1,1,0,0,0,0|1,0,1]=4 1502 B14R2.991 CCNCc1ccc2occc2c1 34a_100020591328_100000210202 [1,1,0,0,0,0|1,0,1]=4 1503 B14R2.991 CCNCc1ccc2ocnc2c1 207a_100015525214_100010271902 [1,1,0,0,0,0|1,0,1]=4 1504 B14R2.991 CCNCc1ccc2ocnc2c1 2230a_100015525214_200010203175 [1,1,0,0,0,0|1,0,1]=4 1505 B14R2.991 CCNCc1ccc2ocnc2c1 270004a_100015525214_100010271902 [1,1,0,0,0,0|1,0,1]=4 1506 B14R2.991 CCOCc1ccc2c(c1)CCC2 34a_200000765175_100000210202 [1,1,0,0,0,0|2,0,0]=4 1507 B14R2.991 CCOCc1ccc2c(c1)CCC2 7a_200000765175_100000210202 [1,1,0,0,0,0|2,0,0]=4 1508 B14R2.991 CCOCc1ccc2c(c1)CCO2 34a_100011219353_100000210202 [1,1,0,0,0,0|1,0,0]=3 1509 B14R2.991 CCOCc1ccc2c(c1)CCO2 7a_100011219353_100000210202 [1,1,0,0,0,0|1,0,0]=3 1510 B14R2.991 CCOCc1ccc2c(c1)NCC2 34a_100000694088_100000210202 [1,1,0,0,0,0|2,0,0]=4 1511 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100000210967_100000210202 [1,1,0,0,0,0|0,0,0]=2 1512 B14R2.991 CCOCc1ccc2c(c1)OCO2 34a_100121572206_100000189651 [1,1,0,0,0,0|0,0,0]=2 1513 B14R2.991 CCOCc1ccc2ccoc2c1 34a_200009859634_100000210202 [1,1,0,0,0,0|1,0,1]=4 1514 B14R2.991 CCOCc1ccc2ccoc2c1 7a_200009859634_100000210202 [1,1,0,0,0,0|1,0,1]=4 1515 B14R2.991 CCOCc1ccc2ncoc2c1 34a_100121572206_106359897996 [1,1,0,0,0,0|1,0,1]=4 1516 B14R2.991 CCOCc1ccc2occc2c1 34a_100000067418_100000210202 [1,1,0,0,0,0|1,0,1]=4 1517 B14R2.991 CCOCc1ccc2occc2c1 7a_100000067418_100000210202 [1,1,0,0,0,0|1,0,1]=4 1518 B14R2.991 CCOCc1ccc2ocnc2c1 34a_100121572206_200010203175 [1,1,0,0,0,0|1,0,1]=4 1519 B14R2.991 CCSCc1ccc2ncoc2c1 62a_100000210202_106359897996 [1,1,0,0,0,0|1,0,1]=4 1520 B14R2.991 CCSCc1ccc2ncoc2c1 62a_106359897996_100000210202 [1,1,0,0,0,0|1,0,1]=4 1521 B14R2.991 CCSCc1ccc2ocnc2c1 62a_100000210202_200010203175 [1,1,0,0,0,0|1,0,1]=4 1522 B14R2.991 CNCCc1ccc2c(c1)CCO2 2230a_106832991635_100000763274 [1,1,0,0,0,0|1,0,0]=3 1523 B14R2.991 CNCCc1ccc2c(c1)CCO2 34a_100102657272_100000763274 [1,1,0,0,0,0|1,0,0]=3 1524 B14R2.991 CNCCc1ccc2c(c1)CCO2 7a_106832991635_100000763274 [1,1,0,0,0,0|1,0,0]=3 1525 B14R2.991 CNCCc1ccc2c(c1)OCO2 2230a_100000204656_200000210301 [1,1,0,0,0,0|0,0,0]=2 1526 B14R2.991 CNCCc1ccc2c(c1)OCO2 34a_100000204656_200000210301 [1,1,0,0,0,0|0,0,0]=2 1527 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100012161074_200000210301 [1,1,0,0,0,0|1,0,0]=3 1528 B14R2.991 COCCc1ccc2c(c1)CCO2 34a_100138415774_100000763274 [1,1,0,0,0,0|1,0,0]=3 1529 B14R2.991 COCCc1ccc2c(c1)CCO2 7a_100012161074_200000210301 [1,1,0,0,0,0|1,0,0]=3 1530 B14R2.991 COCCc1ccc2c(c1)OCO2 34a_100011934097_200000210301 [1,1,0,0,0,0|0,0,0]=2 1531 B14R2.991 COCNc1ccc2c(c1)CCO2 2230a_100000736984_100000766300 [1,1,0,0,0,0|2,0,0]=4 1532 B14R2.991 COCNc1ccc2c(c1)OCO2 2230a_100000209953_100000766300 [1,1,0,0,0,0|1,0,0]=3 1533 B14R2.991 COCSc1ccc2c(c1)CCO2 62a_100000729065_100000766300 [1,1,0,0,0,0|2,0,0]=4 1534 B14R2.991 COCSc1ccc2c(c1)CCO2 62a_100000766300_100000729065 [1,1,0,0,0,0|2,0,0]=4 1535 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100000766300_100009818566 [1,1,0,0,0,0|2,0,0]=4 1536 B14R2.991 COCSc1ccc2c(c1)OCC2 62a_100009818566_100000766300 [1,1,0,0,0,0|2,0,0]=4 1537 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_100000763274_200000210301 [1,1,0,0,0,0|1,0,0]=3 1538 B14R2.991 CSCCc1ccc2c(c1)CCO2 62a_200000210301_100000763274 [1,1,0,0,0,0|1,0,0]=3 1539 B14R2.991 CSCNc1ccc2c(c1)CCO2 2230a_100000736984_100011218213 [1,1,0,0,0,0|2,0,0]=4 1540 B14R2.991 CSCNc1ccc2c(c1)CCO2 34a_100000736984_100011218213 [1,1,0,0,0,0|2,0,0]=4 1541 B14R2.991 CSCNc1ccc2c(c1)OCO2 2230a_100000209953_100011218213 [1,1,0,0,0,0|1,0,0]=3 1542 B14R2.991 CSCNc1ccc2c(c1)OCO2 34a_100000209953_100011218213 [1,1,0,0,0,0|1,0,0]=3 1543 B14R2.991 CSCOc1ccc2c(c1)OCO2 34a_100000210298_100011218213 [1,1,0,0,0,0|1,0,0]=3 1544 B14R2.991 CSCSc1ccc2c(c1)CCO2 62a_100000729065_100011218213 [1,1,0,0,0,0|2,0,0]=4 1545 B14R2.991 CSCSc1ccc2c(c1)CCO2 62a_100011218213_100000729065 [1,1,0,0,0,0|2,0,0]=4 1546 B14R2.991 CSCSc1ccc2c(c1)OCC2 62a_100009818566_100011218213 [1,1,0,0,0,0|2,0,0]=4 1547 B14R2.991 CSCSc1ccc2c(c1)OCC2 62a_100011218213_100009818566 [1,1,0,0,0,0|2,0,0]=4 1548 B14R2.991 FCCNc1ccc2c(c1)CCO2 2230a_100000736984_100011217306 [1,1,0,0,0,0|2,0,0]=4 1549 B14R2.991 FCCNc1ccc2c(c1)CCO2 34a_100000736984_100011217306 [1,1,0,0,0,0|2,0,0]=4 1550 B14R2.991 FCCNc1ccc2c(c1)OCO2 2230a_100000209953_100011217306 [1,1,0,0,0,0|1,0,0]=3 1551 B14R2.991 FCCNc1ccc2c(c1)OCO2 34a_100000209953_100011217306 [1,1,0,0,0,0|1,0,0]=3 1552 B14R2.991 FCCOc1ccc2c(c1)OCO2 34a_100000210298_100011217306 [1,1,0,0,0,0|1,0,0]=3 1553 B14R2.991 FCCSc1ccc2c(c1)CCO2 62a_100000729065_100011217306 [1,1,0,0,0,0|2,0,0]=4 1554 B14R2.991 FCCSc1ccc2c(c1)CCO2 62a_100011217306_100000729065 [1,1,0,0,0,0|2,0,0]=4 1555 B14R2.991 FCCSc1ccc2c(c1)OCC2 62a_100009818566_100011217306 [1,1,0,0,0,0|2,0,0]=4 1556 B14R2.991 FCCSc1ccc2c(c1)OCC2 62a_100011217306_100009818566 [1,1,0,0,0,0|2,0,0]=4 1557 B14R2.991 FCNCc1ccc2c(c1)CCO2 34a_100011219410_100015361967 [1,1,0,0,0,0|2,0,0]=4 1558 B14R2.991 FCNCc1ccc2c(c1)OCO2 34a_100000210006_100015361967 [1,1,0,0,0,0|1,0,0]=3 1559 B14R2.991 FCOCc1ccc2c(c1)CCO2 34a_100011219353_100015361967 [1,1,0,0,0,0|2,0,0]=4 1560 B14R2.991 FCOCc1ccc2c(c1)CCO2 7a_100011219353_100015361967 [1,1,0,0,0,0|2,0,0]=4 1561 B14R2.991 FCOCc1ccc2c(c1)OCO2 34a_100000210967_100015361967 [1,1,0,0,0,0|1,0,0]=3 1562 B14R2.991 N#CCNc1ccc2c(c1)OCO2 2230a_100000209953_100011215382 [1,1,0,0,0,0|0,0,2]=4 1563 B14R2.991 O=CCNc1ccc2c(c1)OCO2 2230a_100000209953_200015260668 [1,1,0,0,0,0|1,0,1]=4 1564 B14R2.991 O=CCNc1ccc2c(c1)OCO2 34a_100000209953_200009817547 [1,1,0,0,0,0|1,0,1]=4 1565 B14R2.991 O=CCOc1ccc2c(c1)OCO2 34a_100000210298_200009817547 [1,1,0,0,0,0|1,0,1]=4 1566 B14R2.991 OCCNc1ccc2c(c1)CCO2 2230a_100000736984_100000211926 [1,1,0,0,0,0|2,0,0]=4 1567 B14R2.991 OCCNc1ccc2c(c1)CCO2 34a_100000736984_100000211926 [1,1,0,0,0,0|2,0,0]=4 1568 B14R2.991 OCCNc1ccc2c(c1)OCO2 2230a_100000209953_100000211926 [1,1,0,0,0,0|1,0,0]=3 1569 B14R2.991 OCCNc1ccc2c(c1)OCO2 34a_100000209953_100000211926 [1,1,0,0,0,0|1,0,0]=3 1570 B14R2.991 OCCOc1ccc2c(c1)OCO2 34a_100000210298_100000211926 [1,1,0,0,0,0|1,0,0]=3 1571 B14R2.991 OCCSc1ccc2c(c1)CCO2 62a_100000211926_100000729065 [1,1,0,0,0,0|2,0,0]=4 1572 B14R2.991 OCCSc1ccc2c(c1)CCO2 62a_100000729065_100000211926 [1,1,0,0,0,0|2,0,0]=4 1573 B14R2.991 OCCSc1ccc2c(c1)OCC2 62a_100000211926_100009818566 [1,1,0,0,0,0|2,0,0]=4 1574 B14R2.991 OCCSc1ccc2c(c1)OCC2 62a_100009818566_100000211926 [1,1,0,0,0,0|2,0,0]=4 1575 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 2230a_100000204656_200025704644 [1,1,0,0,0,0|0,0,0]=2 1576 B14R2.991 [13CH3]NCCc1ccc2c(c1)OCO2 34a_100000204656_200025704644 [1,1,0,0,0,0|0,0,0]=2 1577 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 34a_100012161074_200025704644 [1,1,0,0,0,0|1,0,0]=3 1578 B14R2.991 [13CH3]OCCc1ccc2c(c1)CCO2 7a_100012161074_200025704644 [1,1,0,0,0,0|1,0,0]=3 1579 B14R2.991 [13CH3]OCCc1ccc2c(c1)OCO2 34a_100011934097_200025704644 [1,1,0,0,0,0|0,0,0]=2 1580 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_100000763274_200025704644 [1,1,0,0,0,0|1,0,0]=3 1581 B14R2.991 [13CH3]SCCc1ccc2c(c1)CCO2 62a_200025704644_100000763274 [1,1,0,0,0,0|1,0,0]=3 1582 B14R2.6400 CCNc1ccc2c(c1)CC(O2)C 2230a_100102713350_100000210202 [1,1,0,0,0,0|2,0,0]=4 1583 B14R2.6400 CCNc1ccc2c(c1)CC(O2)C 34a_100102713350_100000210202 [1,1,0,0,0,0|2,0,0]=4 1584 B14R2.6412 CCSc1ccc2c(c1)OCC2=O 62a_100000210202_100000686717 [1,1,0,0,0,0|2,0,0]=4 1585 B14R2.6412 CCSc1ccc2c(c1)OCC2N 62a_100000210202_100020628175 [1,1,0,0,0,0|2,0,0]=4 1586 B14R2.6412 CCSc1ccc2c(c1)OCC2N 62a_100020628175_100000210202 [1,1,0,0,0,0|2,0,0]=4 1587 B14R2.6412 CNCc1ccc2c(c1)OCC2=O 26a_100102657272_100000216533 [1,1,0,0,0,0|2,0,0]=4 1588 B14R2.624 C=C(C)c1cc2c(cc1N)OCO2 271570a_100000694244_100012557033 [0,1,0,0,1,0|1,0,1]=4 1589 B14R2.624 C=C(C)c1cc2c(cc1O)OCO2 271570a_100000694244_100010290809 [0,1,0,0,1,0|1,0,1]=4 1590 B14R2.624 CC(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_200000210301 [0,1,0,0,1,0|1,0,1]=4 1591 B14R2.624 [13CH3]C(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_200025704644 [0,1,0,0,1,0|1,0,1]=4 1592 B14R2.5998 C=C(C)c1ccc2c(c1C)OCO2 271570a_100000694244_100010335860 [0,1,0,0,1,0|1,0,1]=4 1593 B14R2.5998 C=C(C)c1ccc2c(c1F)OCO2 271570a_100000694244_100010223184 [0,1,0,0,1,0|1,0,1]=4 1594 B14R2.5998 CC(=O)c1ccc2c(c1C)OCO2 1458a_100009908537_200000210301 [0,1,0,0,1,0|1,0,1]=4 1595 B14R2.5998 Cc1c(ccc2c1OCO2)C(=O)[13CH3] 1458a_100009908537_200025704644 [0,1,0,0,1,0|1,0,1]=4 1596 B14R2.8824 CC(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_200000210301 [0,1,0,0,1,0|1,0,1]=4 1597 B14R2.8824 [13CH3]C(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_200025704644 [0,1,0,0,1,0|1,0,1]=4 1598 B16R2.3989 CC(=O)Cc1cc2c(cc1Br)OCCO2 1458a_100000701355_200000210301 [0,1,0,0,0,1|1,0,1]=4 1599 B16R2.3989 CC(=O)Cc1cc2c(cc1Cl)OCCO2 1458a_100000068998_200000210301 [0,1,0,0,0,1|1,0,1]=4 1600 B16R2.3989 CC(C)Nc1cc2c(cc1Cl)OCCO2 34a_100000739234_100000210206 [0,1,0,0,0,1|2,0,0]=4 1601 B16R2.3989 Cc1cc2c(cc1CN(C)C)OCCO2 270004a_100102631434_100000101720 [0,1,0,0,0,1|2,0,0]=4 1602 B16R2.3989 [13CH3]C(=O)Cc1cc2c(cc1Br)OCCO2 1458a_100000701355_200025704644 [0,1,0,0,0,1|1,0,1]=4 1603 B16R2.3989 [13CH3]C(=O)Cc1cc2c(cc1Cl)OCCO2 1458a_100000068998_200025704644 [0,1,0,0,0,1|1,0,1]=4 1604 B16R2.5347 C#CC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_200000035995 [0,1,0,0,0,1|2,0,0]=4 1605 B16R2.5347 C#CC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_200000035995 [0,1,0,0,0,1|2,0,0]=4 1606 B16R2.5347 C#CC(C)Sc1ccc2c(c1)OCCO2 62a_200000035995_100011216881 [0,1,0,0,0,1|2,0,0]=4 1607 B16R2.5347 C=CC(C)Sc1ccc2c(c1)OCCO2 62a_100011215867_100011216881 [0,1,0,0,0,1|2,0,0]=4 1608 B16R2.5347 CC(C#N)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000184139 [0,1,0,0,0,1|1,0,1]=4 1609 B16R2.5347 CC(C#N)Sc1ccc2c(c1)OCCO2 62a_100000703298_100011216881 [0,1,0,0,0,1|1,0,1]=4 1610 B16R2.5347 CC(C#N)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000703298 [0,1,0,0,0,1|1,0,1]=4 1611 B16R2.5347 CC(CO)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100012180447 [0,1,0,0,0,1|2,0,0]=4 1612 B16R2.5347 CC(CO)Nc1ccc2c(c1)OCCO2 34a_100020630400_100012180447 [0,1,0,0,0,1|2,0,0]=4 1613 B16R2.5347 CC(CO)Oc1ccc2c(c1)OCCO2 34a_100000234341_100012180447 [0,1,0,0,0,1|2,0,0]=4 1614 B16R2.5347 CC(CO)Sc1ccc2c(c1)OCCO2 62a_100012180447_100011216881 [0,1,0,0,0,1|2,0,0]=4 1615 B16R2.5347 CCC(=O)Cc1ccc2c(c1)OCCO2 1458a_100000184005_100000210202 [0,1,0,0,0,1|1,0,1]=4 1616 B16R2.5347 CCC(C)Nc1ccc2c(c1)OCCO2 2230a_100020630400_100000758301 [0,1,0,0,0,1|2,0,0]=4 1617 B16R2.5347 CCC(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100011215416 [0,1,0,0,0,1|2,0,0]=4 1618 B16R2.5347 CCC(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100011215416 [0,1,0,0,0,1|2,0,0]=4 1619 B16R2.5347 CCC(C)Sc1ccc2c(c1)OCCO2 62a_100000758301_100011216881 [0,1,0,0,0,1|2,0,0]=4 1620 B16R2.5347 CCC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000758301 [0,1,0,0,0,1|2,0,0]=4 1621 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684720_100000210202 [0,1,0,0,0,1|2,0,0]=4 1622 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 2230a_100000684725_200000210301 [0,1,0,0,0,1|2,0,0]=4 1623 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684720_100000204670 [0,1,0,0,0,1|2,0,0]=4 1624 B16R2.5347 CCN(C)Cc1ccc2c(c1)OCCO2 269982a_100000684725_200000210301 [0,1,0,0,0,1|2,0,0]=4 1625 B16R2.5347 CCN([13CH3])Cc1ccc2c(c1)OCCO2 2230a_100000684725_200025704644 [0,1,0,0,0,1|2,0,0]=4 1626 B16R2.5347 CCN([13CH3])Cc1ccc2c(c1)OCCO2 269982a_100000684725_200025704644 [0,1,0,0,0,1|2,0,0]=4 1627 B16R2.5347 CN(CF)Cc1ccc2c(c1)OCCO2 269982a_100000684720_100015361967 [0,1,0,0,0,1|2,0,0]=4 1628 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 11a_106832991635_100000184005 [0,1,0,0,0,1|1,0,1]=4 1629 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 1626a_100102657272_100000184005 [0,1,0,0,0,1|1,0,1]=4 1630 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 240690a_100102657272_100000184005 [0,1,0,0,0,1|1,0,1]=4 1631 B16R2.5347 CNC(=O)Cc1ccc2c(c1)OCCO2 527a_100102657272_100000184005 [0,1,0,0,0,1|1,0,1]=4 1632 B16R2.5347 CNC(C)Cc1ccc2c(c1)OCCO2 270004a_106832991635_200000075428 [0,1,0,0,0,1|0,0,0]=2 1633 B16R2.5347 COC(C)Sc1ccc2c(c1)OCCO2 62a_100009879195_100011216881 [0,1,0,0,0,1|2,0,0]=4 1634 B16R2.5347 COC(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100009879195 [0,1,0,0,0,1|2,0,0]=4 1635 B16R2.5347 C[C@H](CO)Sc1ccc2c(c1)OCCO2 62a_100011216881_100016084084 [0,1,0,0,0,1|2,0,0]=4 1636 B16R2.5347 C[C@H](CO)Sc1ccc2c(c1)OCCO2 62a_100016084084_100011216881 [0,1,0,0,0,1|2,0,0]=4 1637 B16R2.5347 O=C(CF)Cc1ccc2c(c1)OCCO2 1458a_100000184005_100015361967 [0,1,0,0,0,1|1,0,1]=4 1638 B16R2.6284 CC(C)C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_100000210206 [0,1,0,0,0,1|1,0,1]=4 1639 B16R2.6284 CC(c1ccc2c(c1)OCCO2)N(C)C 2230a_200015185192_200000210301 [0,1,0,0,0,1|2,0,0]=4 1640 B16R2.6284 CC(c1ccc2c(c1)OCCO2)N(C)C 269982a_200015185192_200000210301 [0,1,0,0,0,1|2,0,0]=4 1641 B16R2.6284 CC(c1ccc2c(c1)OCCO2)N(C)[13CH3] 2230a_200015185192_200025704644 [0,1,0,0,0,1|2,0,0]=4 1642 B16R2.6284 CC(c1ccc2c(c1)OCCO2)N(C)[13CH3] 269982a_200015185192_200025704644 [0,1,0,0,0,1|2,0,0]=4 1643 B16R2.82802 CC(C)(C)Nc1ccc2c(c1)OCCO2 34a_100020630400_100000210625 [0,1,0,0,0,1|2,0,0]=4 1644 B16R2.82802 CC(C)(C)Oc1ccc2c(c1)OCCO2 34a_100000234341_100000210625 [0,1,0,0,0,1|2,0,0]=4 1645 B16R2.82802 CC(C)(C)Sc1ccc2c(c1)OCCO2 62a_100000211941_100011216881 [0,1,0,0,0,1|2,0,0]=4 1646 B16R2.82802 CC(C)(C)Sc1ccc2c(c1)OCCO2 62a_100011216881_100000211941 [0,1,0,0,0,1|2,0,0]=4 1647 B16R2.83538 Cc1c(ccc2c1OCCO2)SC(C)C 62a_100000210206_100010072848 [0,1,0,0,0,1|2,0,0]=4 1648 B16R2.83538 Cc1c(ccc2c1OCCO2)SC(C)C 62a_100010072848_100000210206 [0,1,0,0,0,1|2,0,0]=4 1649 B16R2.1357 C#CC(C)NCc1ccc2c(c1)CCO2 270004a_100000707721_100011218456 [0,1,0,0,0,1|2,0,0]=4 1650 B16R2.1357 C#CC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_200000035995 [0,1,0,0,0,1|2,0,0]=4 1651 B16R2.1357 C#CC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_200000035995 [0,1,0,0,0,1|1,0,0]=3 1652 B16R2.1357 C#CC(C)NCc1ccc2c(c1)OCO2 34a_100000707721_100000189651 [0,1,0,0,0,1|1,0,0]=3 1653 B16R2.1357 C#CC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_200000035995 [0,1,0,0,0,1|2,0,0]=4 1654 B16R2.1357 C#CC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_200000035995 [0,1,0,0,0,1|1,0,0]=3 1655 B16R2.1357 C#C[C@@H](C)OCc1ccc2c(c1)OCO2 34a_100009815206_100000189651 [0,1,0,0,0,1|1,0,0]=3 1656 B16R2.1357 C#C[C@@H](C)OCc1ccc2c(c1)OCO2 7a_100009815206_100000189651 [0,1,0,0,0,1|1,0,0]=3 1657 B16R2.1357 C=CC(C)OCc1ccc2c(c1)OCO2 34a_100000695699_100000189651 [0,1,0,0,0,1|1,0,0]=3 1658 B16R2.1357 C=CC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000730141 [0,1,0,0,0,1|1,0,1]=4 1659 B16R2.1357 C=CC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000730141 [0,1,0,0,0,1|1,0,1]=4 1660 B16R2.1357 C=CC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100000730141 [0,1,0,0,0,1|1,0,1]=4 1661 B16R2.1357 CC(C#N)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000184139 [0,1,0,0,0,1|1,0,1]=4 1662 B16R2.1357 CC(C#N)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000184139 [0,1,0,0,0,1|0,0,1]=3 1663 B16R2.1357 CC(C#N)OCc1ccc2c(c1)CCO2 7a_100011219353_100000703298 [0,1,0,0,0,1|1,0,1]=4 1664 B16R2.1357 CC(C#N)OCc1ccc2c(c1)OCO2 34a_100011218135_100000189651 [0,1,0,0,0,1|0,0,1]=3 1665 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 34a_100000744918_200025704644 [0,1,0,0,0,1|1,0,0]=3 1666 B16R2.1357 CC(CCc1ccc2c(c1)OCO2)O[13CH3] 7a_100000744918_200025704644 [0,1,0,0,0,1|1,0,0]=3 1667 B16R2.1357 CC(CF)OCc1ccc2c(c1)OCO2 34a_100016041109_100000189651 [0,1,0,0,0,1|1,0,0]=3 1668 B16R2.1357 CC(CF)OCc1ccc2c(c1)OCO2 7a_100016041109_100000189651 [0,1,0,0,0,1|1,0,0]=3 1669 B16R2.1357 CC(CN)OCc1ccc2c(c1)OCO2 34a_100000210904_100000189651 [0,1,0,0,0,1|0,0,0]=2 1670 B16R2.1357 CC(CN)OCc1ccc2ncoc2c1 34a_100000210904_106359897996 [0,1,0,0,0,1|1,0,1]=4 1671 B16R2.1357 CC(CN)OCc1ccc2ocnc2c1 34a_100000210904_200010203175 [0,1,0,0,0,1|1,0,1]=4 1672 B16R2.1357 CC(CO)NCc1ccc2c(c1)CCO2 2230a_100011219410_100012180447 [0,1,0,0,0,1|2,0,0]=4 1673 B16R2.1357 CC(CO)NCc1ccc2c(c1)CCO2 34a_100011219410_100012180447 [0,1,0,0,0,1|2,0,0]=4 1674 B16R2.1357 CC(CO)NCc1ccc2c(c1)OCO2 2230a_100000210006_100012180447 [0,1,0,0,0,1|1,0,0]=3 1675 B16R2.1357 CC(CO)NCc1ccc2c(c1)OCO2 34a_100000210006_100012180447 [0,1,0,0,0,1|1,0,0]=3 1676 B16R2.1357 CC(CO)OCc1ccc2c(c1)CCO2 34a_100011219353_100012180447 [0,1,0,0,0,1|2,0,0]=4 1677 B16R2.1357 CC(CO)OCc1ccc2c(c1)CCO2 7a_100011219353_100012180447 [0,1,0,0,0,1|2,0,0]=4 1678 B16R2.1357 CC(CO)OCc1ccc2c(c1)OCO2 34a_100000210967_100012180447 [0,1,0,0,0,1|1,0,0]=3 1679 B16R2.1357 CCC(=O)CCc1ccc2c(c1)OCO2 1458a_100000235677_100000210202 [0,1,0,0,0,1|1,0,1]=4 1680 B16R2.1357 CCC(=O)COc1ccc2c(c1)OCO2 1458a_100000246017_100000210202 [0,1,0,0,0,1|1,0,1]=4 1681 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 11a_100000210006_100000210414 [0,1,0,0,0,1|1,0,1]=4 1682 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 1626a_100000210006_100000210414 [0,1,0,0,0,1|1,0,1]=4 1683 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210414 [0,1,0,0,0,1|1,0,1]=4 1684 B16R2.1357 CCC(=O)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210414 [0,1,0,0,0,1|1,0,1]=4 1685 B16R2.1357 CCC(C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000748023 [0,1,0,0,0,1|2,0,0]=4 1686 B16R2.1357 CCC(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100000748023 [0,1,0,0,0,1|2,0,0]=4 1687 B16R2.1357 CCC(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000748023 [0,1,0,0,0,1|1,0,0]=3 1688 B16R2.1357 CCC(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100000748023 [0,1,0,0,0,1|1,0,0]=3 1689 B16R2.1357 CCC(C)COc1ccc2c(c1)OCO2 34a_100000210298_100000748023 [0,1,0,0,0,1|1,0,0]=3 1690 B16R2.1357 CCC(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100000748023 [0,1,0,0,0,1|2,0,0]=4 1691 B16R2.1357 CCC(C)CSc1ccc2c(c1)CCO2 62a_100000748023_100000729065 [0,1,0,0,0,1|2,0,0]=4 1692 B16R2.1357 CCC(C)CSc1ccc2c(c1)OCC2 62a_100000748023_100009818566 [0,1,0,0,0,1|2,0,0]=4 1693 B16R2.1357 CCC(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100000748023 [0,1,0,0,0,1|2,0,0]=4 1694 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 207a_100000209981_100011218456 [0,1,0,0,0,1|2,0,0]=4 1695 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 2230a_100011219410_100000758301 [0,1,0,0,0,1|2,0,0]=4 1696 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 270004a_100000209981_100011218456 [0,1,0,0,0,1|2,0,0]=4 1697 B16R2.1357 CCC(C)NCc1ccc2c(c1)CCO2 34a_100011219410_100011215416 [0,1,0,0,0,1|2,0,0]=4 1698 B16R2.1357 CCC(C)NCc1ccc2c(c1)OCO2 2230a_100000210006_100000758301 [0,1,0,0,0,1|1,0,0]=3 1699 B16R2.1357 CCC(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100011215416 [0,1,0,0,0,1|1,0,0]=3 1700 B16R2.1357 CCC(C)OCc1ccc2c(c1)CCO2 34a_100011219353_100011215416 [0,1,0,0,0,1|2,0,0]=4 1701 B16R2.1357 CCC(C)OCc1ccc2c(c1)CCO2 7a_100011219353_100000758301 [0,1,0,0,0,1|2,0,0]=4 1702 B16R2.1357 CCC(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100011215416 [0,1,0,0,0,1|1,0,0]=3 1703 B16R2.1357 CCC(C)OCc1ccc2c(c1)OCO2 7a_100000210228_100000189651 [0,1,0,0,0,1|1,0,0]=3 1704 B16R2.1357 CCC(O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100011218378 [0,1,0,0,0,1|2,0,0]=4 1705 B16R2.1357 CCC(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100011218378 [0,1,0,0,0,1|2,0,0]=4 1706 B16R2.1357 CCC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011218378 [0,1,0,0,0,1|1,0,0]=3 1707 B16R2.1357 CCC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011218378 [0,1,0,0,0,1|1,0,0]=3 1708 B16R2.1357 CCC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011218378 [0,1,0,0,0,1|1,0,0]=3 1709 B16R2.1357 CCC(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100011218378 [0,1,0,0,0,1|2,0,0]=4 1710 B16R2.1357 CCC(O)CSc1ccc2c(c1)CCO2 62a_100011218378_100000729065 [0,1,0,0,0,1|2,0,0]=4 1711 B16R2.1357 CCC(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100011218378 [0,1,0,0,0,1|2,0,0]=4 1712 B16R2.1357 CCC(O)CSc1ccc2c(c1)OCC2 62a_100011218378_100009818566 [0,1,0,0,0,1|2,0,0]=4 1713 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)CCO2 2230a_100000736984_100009816398 [0,1,0,0,0,1|2,0,0]=4 1714 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)CCO2 34a_100000736984_100009816398 [0,1,0,0,0,1|2,0,0]=4 1715 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009816398 [0,1,0,0,0,1|1,0,0]=3 1716 B16R2.1357 CC[C@H](C)CNc1ccc2c(c1)OCO2 34a_100000209953_100009816398 [0,1,0,0,0,1|1,0,0]=3 1717 B16R2.1357 CC[C@H](C)COc1ccc2c(c1)OCO2 34a_100000210298_100009816398 [0,1,0,0,0,1|1,0,0]=3 1718 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)CCO2 62a_100000729065_100009816398 [0,1,0,0,0,1|2,0,0]=4 1719 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)CCO2 62a_100009816398_100000729065 [0,1,0,0,0,1|2,0,0]=4 1720 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)OCC2 62a_100009816398_100009818566 [0,1,0,0,0,1|2,0,0]=4 1721 B16R2.1357 CC[C@H](C)CSc1ccc2c(c1)OCC2 62a_100009818566_100009816398 [0,1,0,0,0,1|2,0,0]=4 1722 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 11a_106832991635_100000235677 [0,1,0,0,0,1|1,0,1]=4 1723 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 1626a_100102657272_100000235677 [0,1,0,0,0,1|1,0,1]=4 1724 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 240690a_100102657272_100000235677 [0,1,0,0,0,1|1,0,1]=4 1725 B16R2.1357 CNC(=O)CCc1ccc2c(c1)OCO2 527a_100102657272_100000235677 [0,1,0,0,0,1|1,0,1]=4 1726 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000183359 [0,1,0,0,0,1|1,0,1]=4 1727 B16R2.1357 CNC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000183359 [0,1,0,0,0,1|1,0,1]=4 1728 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 11a_106832991635_100000246017 [0,1,0,0,0,1|1,0,1]=4 1729 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 1626a_100102657272_100000246017 [0,1,0,0,0,1|1,0,1]=4 1730 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 240690a_100102657272_100000246017 [0,1,0,0,0,1|1,0,1]=4 1731 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000183359 [0,1,0,0,0,1|1,0,1]=4 1732 B16R2.1357 CNC(=O)COc1ccc2c(c1)OCO2 527a_100102657272_100000246017 [0,1,0,0,0,1|1,0,1]=4 1733 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100000210006_106832991635 [0,1,0,0,0,1|1,0,1]=4 1734 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 2708a_100102657272_100000210006 [0,1,0,0,0,1|1,0,1]=4 1735 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100000210006_100102657272 [0,1,0,0,0,1|1,0,1]=4 1736 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 273464a_100102657272_100000210006 [0,1,0,0,0,1|1,0,1]=4 1737 B16R2.1357 CNC(=O)NCc1ccc2c(c1)OCO2 512a_106832991638_100000210006 [0,1,0,0,0,1|1,0,1]=4 1738 B16R2.1357 CNC(C)CCc1ccc2c(c1)OCO2 270004a_106832991635_100000182259 [0,1,0,0,0,1|0,0,0]=2 1739 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000747449 [0,1,0,0,0,1|1,0,1]=4 1740 B16R2.1357 COC(=O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000747449 [0,1,0,0,0,1|1,0,1]=4 1741 B16R2.1357 COC(=O)COc1ccc2c(c1)OCO2 34a_100000210298_100000747449 [0,1,0,0,0,1|1,0,1]=4 1742 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 34a_100000744918_200000210301 [0,1,0,0,0,1|1,0,0]=3 1743 B16R2.1357 COC(C)CCc1ccc2c(c1)OCO2 7a_100000744918_200000210301 [0,1,0,0,0,1|1,0,0]=3 1744 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)CCO2 2230a_100000736984_100000059175 [0,1,0,0,0,1|2,0,0]=4 1745 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)CCO2 34a_100000736984_100000059175 [0,1,0,0,0,1|2,0,0]=4 1746 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000059175 [0,1,0,0,0,1|1,0,0]=3 1747 B16R2.1357 C[C@@H](CO)CNc1ccc2c(c1)OCO2 34a_100000209953_100000059175 [0,1,0,0,0,1|1,0,0]=3 1748 B16R2.1357 C[C@@H](CO)COc1ccc2c(c1)OCO2 34a_100000210298_100000059175 [0,1,0,0,0,1|1,0,0]=3 1749 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)CCO2 62a_100000059175_100000729065 [0,1,0,0,0,1|2,0,0]=4 1750 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)CCO2 62a_100000729065_100000059175 [0,1,0,0,0,1|2,0,0]=4 1751 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)OCC2 62a_100000059175_100009818566 [0,1,0,0,0,1|2,0,0]=4 1752 B16R2.1357 C[C@@H](CO)CSc1ccc2c(c1)OCC2 62a_100009818566_100000059175 [0,1,0,0,0,1|2,0,0]=4 1753 B16R2.1357 C[C@H](CF)NCc1ccc2c(c1)CCO2 207a_100102880703_100011218456 [0,1,0,0,0,1|2,0,0]=4 1754 B16R2.1357 C[C@H](CF)NCc1ccc2c(c1)CCO2 270004a_100102880703_100011218456 [0,1,0,0,0,1|2,0,0]=4 1755 B16R2.1357 C[C@H](CO)NCc1ccc2c(c1)CCO2 207a_100000737577_100011218456 [0,1,0,0,0,1|2,0,0]=4 1756 B16R2.1357 C[C@H](CO)NCc1ccc2c(c1)CCO2 270004a_100000737577_100011218456 [0,1,0,0,0,1|2,0,0]=4 1757 B16R2.1357 O=C(CF)CCc1ccc2c(c1)OCO2 1458a_100000235677_100015361967 [0,1,0,0,0,1|1,0,1]=4 1758 B16R2.1357 O=C(CF)COc1ccc2c(c1)OCO2 1458a_100000246017_100015361967 [0,1,0,0,0,1|1,0,1]=4 1759 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 240690a_100000210006_100000210174 [0,1,0,0,0,1|1,0,1]=4 1760 B16R2.1357 O=C(CO)NCc1ccc2c(c1)OCO2 527a_100000210006_100000210174 [0,1,0,0,0,1|1,0,1]=4 1761 B16R2.1357 OCC(O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100011219619 [0,1,0,0,0,1|2,0,0]=4 1762 B16R2.1357 OCC(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100011219619 [0,1,0,0,0,1|2,0,0]=4 1763 B16R2.1357 OCC(O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100011219619 [0,1,0,0,0,1|1,0,0]=3 1764 B16R2.1357 OCC(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100011219619 [0,1,0,0,0,1|1,0,0]=3 1765 B16R2.1357 OCC(O)COc1ccc2c(c1)OCO2 34a_100000210298_100011219619 [0,1,0,0,0,1|1,0,0]=3 1766 B16R2.1357 OCC(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100011219619 [0,1,0,0,0,1|2,0,0]=4 1767 B16R2.1357 OCC(O)CSc1ccc2c(c1)CCO2 62a_100011219619_100000729065 [0,1,0,0,0,1|2,0,0]=4 1768 B16R2.1357 OCC(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100011219619 [0,1,0,0,0,1|2,0,0]=4 1769 B16R2.1357 OCC(O)CSc1ccc2c(c1)OCC2 62a_100011219619_100009818566 [0,1,0,0,0,1|2,0,0]=4 1770 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)CCO2 2230a_100000736984_100009815848 [0,1,0,0,0,1|2,0,0]=4 1771 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)CCO2 34a_100000736984_100009815848 [0,1,0,0,0,1|2,0,0]=4 1772 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)OCO2 2230a_100000209953_100009815848 [0,1,0,0,0,1|1,0,0]=3 1773 B16R2.1357 OC[C@H](O)CNc1ccc2c(c1)OCO2 34a_100000209953_100009815848 [0,1,0,0,0,1|1,0,0]=3 1774 B16R2.1357 OC[C@H](O)COc1ccc2c(c1)OCO2 34a_100000210298_100009815848 [0,1,0,0,0,1|1,0,0]=3 1775 B16R2.1357 OC[C@H](O)CSc1ccc2c(c1)CCO2 62a_100000729065_100009815848 [0,1,0,0,0,1|2,0,0]=4 1776 B16R2.1357 OC[C@H](O)CSc1ccc2c(c1)CCO2 62a_100009815848_100000729065 [0,1,0,0,0,1|2,0,0]=4 1777 B16R2.1357 OC[C@H](O)CSc1ccc2c(c1)OCC2 62a_100009815848_100009818566 [0,1,0,0,0,1|2,0,0]=4 1778 B16R2.1357 OC[C@H](O)CSc1ccc2c(c1)OCC2 62a_100009818566_100009815848 [0,1,0,0,0,1|2,0,0]=4 1779 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)CCO2 2230a_100000736984_100015614560 [0,1,0,0,0,1|2,0,0]=4 1780 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)CCO2 34a_100000736984_100015614560 [0,1,0,0,0,1|2,0,0]=4 1781 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)OCO2 2230a_100000209953_100015614560 [0,1,0,0,0,1|1,0,0]=3 1782 B16R2.1357 O[C@@H](CF)CNc1ccc2c(c1)OCO2 34a_100000209953_100015614560 [0,1,0,0,0,1|1,0,0]=3 1783 B16R2.1357 O[C@@H](CF)COc1ccc2c(c1)OCO2 34a_100000210298_100015614560 [0,1,0,0,0,1|1,0,0]=3 1784 B16R2.1357 O[C@@H](CF)CSc1ccc2c(c1)CCO2 62a_100000729065_100015614560 [0,1,0,0,0,1|2,0,0]=4 1785 B16R2.1357 O[C@@H](CF)CSc1ccc2c(c1)CCO2 62a_100015614560_100000729065 [0,1,0,0,0,1|2,0,0]=4 1786 B16R2.1357 O[C@@H](CF)CSc1ccc2c(c1)OCC2 62a_100009818566_100015614560 [0,1,0,0,0,1|2,0,0]=4 1787 B16R2.1357 O[C@@H](CF)CSc1ccc2c(c1)OCC2 62a_100015614560_100009818566 [0,1,0,0,0,1|2,0,0]=4 1788 B16R2.3892 CC(C)CNc1ccc2c(c1)CC(O2)C 2230a_100102713350_100000210760 [0,1,0,0,0,1|2,0,0]=4 1789 B16R2.3892 CC(C)CNc1ccc2c(c1)CC(O2)C 34a_100102713350_100000210624 [0,1,0,0,0,1|2,0,0]=4 1790 B16R2.3892 CC(O)CNc1ccc2c(c1)CC(O2)C 2230a_100102713350_100011218427 [0,1,0,0,0,1|2,0,0]=4 1791 B16R2.3892 CC(O)CNc1ccc2c(c1)CC(O2)C 34a_100102713350_100011218427 [0,1,0,0,0,1|2,0,0]=4 1792 B16R2.3892 CC1Cc2cc(ccc2O1)NC[C@@H](C)O 2230a_100102713350_100009817552 [0,1,0,0,0,1|2,0,0]=4 1793 B16R2.3892 CC1Cc2cc(ccc2O1)NC[C@@H](C)O 34a_100102713350_100009817552 [0,1,0,0,0,1|2,0,0]=4 1794 B16R2.3954 C=C(C)CNc1cc2c(cc1C)OCO2 2230a_100000066439_100000748629 [0,1,0,0,0,1|1,0,1]=4 1795 B16R2.3954 C=C(C)CNc1cc2c(cc1C)OCO2 34a_100000066439_100000748629 [0,1,0,0,0,1|1,0,1]=4 1796 B16R2.3954 C=C(C)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000748629 [0,1,0,0,0,1|1,0,1]=4 1797 B16R2.3954 C=C(C)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000748629 [0,1,0,0,0,1|1,0,1]=4 1798 B16R2.3954 C=C(C)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000748629 [0,1,0,0,0,1|1,0,1]=4 1799 B16R2.3954 C=C(C)COc1cc2c(cc1C)OCO2 34a_100000145572_100000748629 [0,1,0,0,0,1|1,0,1]=4 1800 B16R2.3954 C=C(C)COc1cc2c(cc1C)OCO2 7a_100000145572_100000748629 [0,1,0,0,0,1|1,0,1]=4 1801 B16R2.3954 C=C(C)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000211660 [0,1,0,0,0,1|1,0,1]=4 1802 B16R2.3954 CC(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200000210301 [0,1,0,0,0,1|1,0,1]=4 1803 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 11a_200011199097_100015343762 [0,1,0,0,0,1|1,0,1]=4 1804 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 1626a_200011199097_100015343762 [0,1,0,0,0,1|1,0,1]=4 1805 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 240690a_200011199097_100015343762 [0,1,0,0,0,1|1,0,1]=4 1806 B16R2.3954 CC(=O)NCc1cc2c(cc1Br)OCO2 527a_200011199097_100103153847 [0,1,0,0,0,1|1,0,1]=4 1807 B16R2.3954 CC(C)C=Cc1cc2c(cc1N)OCO2 271570a_100016257149_100012557033 [0,1,0,0,0,1|1,0,1]=4 1808 B16R2.3954 CC(C)C=Cc1cc2c(cc1O)OCO2 271570a_100016257149_100010290809 [0,1,0,0,0,1|1,0,1]=4 1809 B16R2.3954 CC(C)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210624 [0,1,0,0,0,1|1,0,0]=3 1810 B16R2.3954 CC(C)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000210624 [0,1,0,0,0,1|1,0,0]=3 1811 B16R2.3954 CC(C)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000210760 [0,1,0,0,0,1|1,0,0]=3 1812 B16R2.3954 CC(C)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000210760 [0,1,0,0,0,1|1,0,0]=3 1813 B16R2.3954 CC(C)NCc1cc2c(cc1Br)OCO2 2230a_100138425928_100009995336 [0,1,0,0,0,1|1,0,0]=3 1814 B16R2.3954 CC(C)NCc1cc2c(cc1Br)OCO2 2230a_200011199097_100000210206 [0,1,0,0,0,1|1,0,0]=3 1815 B16R2.3954 CC(C)NCc1cc2c(cc1Br)OCO2 34a_100138425928_100009995336 [0,1,0,0,0,1|1,0,0]=3 1816 B16R2.3954 CC(C)NCc1cc2c(cc1Cl)OCO2 207a_100138425928_100000015535 [0,1,0,0,0,1|1,0,0]=3 1817 B16R2.3954 CC(C)OCc1cc2c(cc1Br)OCO2 34a_100000187691_100000210206 [0,1,0,0,0,1|1,0,0]=3 1818 B16R2.3954 CC(C)OCc1cc2c(cc1Br)OCO2 34a_100000212225_100009995336 [0,1,0,0,0,1|1,0,0]=3 1819 B16R2.3954 CC(C)OCc1cc2c(cc1Br)OCO2 7a_100000187691_100000210206 [0,1,0,0,0,1|1,0,0]=3 1820 B16R2.3954 CC(C)OCc1cc2c(cc1Cl)OCO2 34a_200000238738_100000210206 [0,1,0,0,0,1|1,0,0]=3 1821 B16R2.3954 CC(C)OCc1cc2c(cc1Cl)OCO2 7a_200000238738_100000210206 [0,1,0,0,0,1|1,0,0]=3 1822 B16R2.3954 CC(C)SCc1cc2c(cc1Br)OCO2 62a_100009995336_100000210206 [0,1,0,0,0,1|1,0,0]=3 1823 B16R2.3954 CC(C)SCc1cc2c(cc1Cl)OCO2 62a_100000043460_100000210206 [0,1,0,0,0,1|1,0,0]=3 1824 B16R2.3954 CC(O)C=Cc1cc2c(cc1N)OCO2 271570a_200011019289_100012557033 [0,1,0,0,0,1|1,0,1]=4 1825 B16R2.3954 CC(O)C=Cc1cc2c(cc1O)OCO2 271570a_200011019289_100010290809 [0,1,0,0,0,1|1,0,1]=4 1826 B16R2.3954 CC(O)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100011218427 [0,1,0,0,0,1|1,0,0]=3 1827 B16R2.3954 CC(O)COc1cc2c(cc1Br)OCO2 34a_100010290809_100011218427 [0,1,0,0,0,1|1,0,0]=3 1828 B16R2.3954 CC(O)COc1cc2c(cc1Br)OCO2 7a_100010290809_100011218427 [0,1,0,0,0,1|1,0,0]=3 1829 B16R2.3954 CC(O)CSc1cc2c(cc1N)OCO2 62a_100012557033_100011218427 [0,1,0,0,0,1|1,0,0]=3 1830 B16R2.3954 C[C@@H](O)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100009817552 [0,1,0,0,0,1|1,0,0]=3 1831 B16R2.3954 C[C@@H](O)COc1cc2c(cc1Br)OCO2 34a_100010290809_100009817552 [0,1,0,0,0,1|1,0,0]=3 1832 B16R2.3954 C[C@@H](O)COc1cc2c(cc1Br)OCO2 7a_100010290809_100009817552 [0,1,0,0,0,1|1,0,0]=3 1833 B16R2.3954 C[C@@H](O)CSc1cc2c(cc1N)OCO2 62a_100012557033_100009817552 [0,1,0,0,0,1|1,0,0]=3 1834 B16R2.3954 Cc1cc2c(cc1NCC(=O)N)OCO2 2230a_100000066439_100000747473 [0,1,0,0,0,1|1,0,1]=4 1835 B16R2.3954 Cc1cc2c(cc1NCC(=O)N)OCO2 34a_100000066439_100000187820 [0,1,0,0,0,1|1,0,1]=4 1836 B16R2.3954 Cc1cc2c(cc1NCC(C)C)OCO2 2230a_100000066439_100000210760 [0,1,0,0,0,1|1,0,0]=3 1837 B16R2.3954 Cc1cc2c(cc1NCC(C)C)OCO2 34a_100000066439_100000210624 [0,1,0,0,0,1|1,0,0]=3 1838 B16R2.3954 Cc1cc2c(cc1NCC(C)O)OCO2 2230a_100000066439_100011218427 [0,1,0,0,0,1|1,0,0]=3 1839 B16R2.3954 Cc1cc2c(cc1NCC(C)O)OCO2 34a_100000066439_100011218427 [0,1,0,0,0,1|1,0,0]=3 1840 B16R2.3954 Cc1cc2c(cc1NCC(F)F)OCO2 2230a_100000066439_100011934356 [0,1,0,0,0,1|2,0,0]=4 1841 B16R2.3954 Cc1cc2c(cc1NCC(F)F)OCO2 34a_100000066439_100011934356 [0,1,0,0,0,1|2,0,0]=4 1842 B16R2.3954 Cc1cc2c(cc1NC[C@@H](C)O)OCO2 2230a_100000066439_100009817552 [0,1,0,0,0,1|1,0,0]=3 1843 B16R2.3954 Cc1cc2c(cc1NC[C@@H](C)O)OCO2 34a_100000066439_100009817552 [0,1,0,0,0,1|1,0,0]=3 1844 B16R2.3954 Cc1cc2c(cc1OCC(=O)N)OCO2 34a_100000145572_100000187820 [0,1,0,0,0,1|1,0,1]=4 1845 B16R2.3954 Cc1cc2c(cc1OCC(=O)N)OCO2 7a_100000145572_100000187820 [0,1,0,0,0,1|1,0,1]=4 1846 B16R2.3954 Cc1cc2c(cc1OCC(C)C)OCO2 34a_100000145572_100000210624 [0,1,0,0,0,1|1,0,0]=3 1847 B16R2.3954 Cc1cc2c(cc1OCC(C)C)OCO2 7a_100000145572_100000210760 [0,1,0,0,0,1|1,0,0]=3 1848 B16R2.3954 Cc1cc2c(cc1OCC(C)O)OCO2 34a_100000145572_100011218427 [0,1,0,0,0,1|1,0,0]=3 1849 B16R2.3954 Cc1cc2c(cc1OCC(C)O)OCO2 7a_100000145572_100011218427 [0,1,0,0,0,1|1,0,0]=3 1850 B16R2.3954 Cc1cc2c(cc1OCC(F)F)OCO2 34a_100000145572_100011934356 [0,1,0,0,0,1|2,0,0]=4 1851 B16R2.3954 Cc1cc2c(cc1OCC(F)F)OCO2 7a_100000145572_100011934356 [0,1,0,0,0,1|2,0,0]=4 1852 B16R2.3954 Cc1cc2c(cc1OC[C@@H](C)O)OCO2 34a_100000145572_100009817552 [0,1,0,0,0,1|1,0,0]=3 1853 B16R2.3954 Cc1cc2c(cc1OC[C@@H](C)O)OCO2 7a_100000145572_100009817552 [0,1,0,0,0,1|1,0,0]=3 1854 B16R2.3954 FC(F)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100011934356 [0,1,0,0,0,1|2,0,0]=4 1855 B16R2.3954 FC(F)COc1cc2c(cc1Br)OCO2 34a_100010290809_100011934356 [0,1,0,0,0,1|2,0,0]=4 1856 B16R2.3954 FC(F)COc1cc2c(cc1Br)OCO2 7a_100010290809_100011934356 [0,1,0,0,0,1|2,0,0]=4 1857 B16R2.3954 NC(=O)CNc1cc2c(cc1Cl)OCO2 34a_100000234339_100000187820 [0,1,0,0,0,1|1,0,1]=4 1858 B16R2.3954 NC(=O)COc1cc2c(cc1Br)OCO2 34a_100010290809_100000187820 [0,1,0,0,0,1|1,0,1]=4 1859 B16R2.3954 NC(=O)COc1cc2c(cc1Br)OCO2 7a_100010290809_100000187820 [0,1,0,0,0,1|1,0,1]=4 1860 B16R2.3954 NC(=O)CSc1cc2c(cc1N)OCO2 62a_100012557033_100000747473 [0,1,0,0,0,1|1,0,1]=4 1861 B16R2.3954 Nc1cc2c(cc1SCC(F)F)OCO2 62a_100012557033_100011934356 [0,1,0,0,0,1|2,0,0]=4 1862 B16R2.3954 [13CH3]C(=O)CCc1cc2c(cc1Br)OCO2 1458a_200009827803_200025704644 [0,1,0,0,0,1|1,0,1]=4 1863 B16R2.6257 CC(=O)C(C)Cc1ccc2c(c1)OCO2 1458a_100000062412_200000210301 [0,1,0,0,0,1|1,0,1]=4 1864 B16R2.6257 CC(=O)C(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009814033 [0,1,0,0,0,1|1,0,1]=4 1865 B16R2.6257 CC(=O)C(C)Oc1ccc2c(c1)OCO2 1458a_100000246018_200000210301 [0,1,0,0,0,1|1,0,1]=4 1866 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 11a_100000186720_100015343762 [0,1,0,0,0,1|1,0,1]=4 1867 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 240690a_100000186720_100015343762 [0,1,0,0,0,1|1,0,1]=4 1868 B16R2.6257 CC(=O)N(C)Cc1ccc2c(c1)OCO2 527a_100000186720_100103153847 [0,1,0,0,0,1|1,0,1]=4 1869 B16R2.6257 CC(C)C(=O)Cc1ccc2c(c1)CCO2 1458a_100000242752_100000210206 [0,1,0,0,0,1|2,0,0]=4 1870 B16R2.6257 CC(C)C(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210206 [0,1,0,0,0,1|1,0,0]=3 1871 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000210198 [0,1,0,0,0,1|1,0,1]=4 1872 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000210198 [0,1,0,0,0,1|1,0,1]=4 1873 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000210198 [0,1,0,0,0,1|1,0,1]=4 1874 B16R2.6257 CC(C)C(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100000210198 [0,1,0,0,0,1|1,0,1]=4 1875 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)CCO2 270004a_200000211004_100011218456 [0,1,0,0,0,1|2,0,0]=4 1876 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210206 [0,1,0,0,0,1|1,0,0]=3 1877 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 2230a_100015183898_200000210301 [0,1,0,0,0,1|1,0,0]=3 1878 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210206 [0,1,0,0,0,1|1,0,0]=3 1879 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_100015183898_200000210301 [0,1,0,0,0,1|1,0,0]=3 1880 B16R2.6257 CC(C)N(C)Cc1ccc2c(c1)OCO2 269982a_200000211004_100000189651 [0,1,0,0,0,1|1,0,0]=3 1881 B16R2.6257 CC(C)N([13CH3])Cc1ccc2c(c1)OCO2 2230a_100015183898_200025704644 [0,1,0,0,0,1|1,0,0]=3 1882 B16R2.6257 CC(C)N([13CH3])Cc1ccc2c(c1)OCO2 269982a_100015183898_200025704644 [0,1,0,0,0,1|1,0,0]=3 1883 B16R2.6257 CC(Cc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000062412_200025704644 [0,1,0,0,0,1|1,0,1]=4 1884 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)OCO2 11a_100000209953_100000062450 [0,1,0,0,0,1|1,0,1]=4 1885 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_100000062450 [0,1,0,0,0,1|1,0,1]=4 1886 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000062450 [0,1,0,0,0,1|1,0,1]=4 1887 B16R2.6257 CC(F)C(=O)Nc1ccc2c(c1)OCO2 527a_100000209953_100000062450 [0,1,0,0,0,1|1,0,1]=4 1888 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 2230a_100000209953_100000702099 [0,1,0,0,0,1|1,0,1]=4 1889 B16R2.6257 CC(Nc1ccc2c(c1)OCO2)C(=O)N 34a_100000209953_100000702099 [0,1,0,0,0,1|1,0,1]=4 1890 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)N 34a_100000210298_100000702099 [0,1,0,0,0,1|1,0,1]=4 1891 B16R2.6257 CC(Oc1ccc2c(c1)OCO2)C(=O)[13CH3] 1458a_100000246018_200025704644 [0,1,0,0,0,1|1,0,1]=4 1892 B16R2.6257 CN(C)C(=O)Cc1ccc2c(c1)OCO2 11a_100102631434_100000743733 [0,1,0,0,0,1|2,0,0]=4 1893 B16R2.6257 CN(C)C(=O)Cc1ccc2c(c1)OCO2 240690a_100102631434_100000743733 [0,1,0,0,0,1|2,0,0]=4 1894 B16R2.6257 CN(C)C(=O)Cc1ccc2c(c1)OCO2 527a_100102631434_100000743733 [0,1,0,0,0,1|2,0,0]=4 1895 B16R2.6257 C[C@@H](O)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_100000717761 [0,1,0,0,0,1|1,0,1]=4 1896 B16R2.6257 C[C@H](O)C(=O)Nc1ccc2c(c1)OCO2 1626a_100000209953_217856618621 [0,1,0,0,0,1|1,0,1]=4 1897 B16R2.6257 C[C@H](O)C(=O)Nc1ccc2c(c1)OCO2 22a_100000209953_217856618621 [0,1,0,0,0,1|1,0,1]=4 1898 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009813875 [0,1,0,0,0,1|1,0,1]=4 1899 B16R2.6257 NC(=O)C(F)Nc1ccc2c(c1)OCO2 34a_100000209953_100009813875 [0,1,0,0,0,1|1,0,1]=4 1900 B16R2.6257 NC(=O)C(F)Oc1ccc2c(c1)OCO2 34a_100000210298_100009813875 [0,1,0,0,0,1|1,0,1]=4 1901 B16R2.11587 C=C(C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000748629 [0,1,0,0,0,1|1,0,1]=4 1902 B16R2.11587 CC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000070787_100000181162 [0,1,0,0,0,1|1,0,1]=4 1903 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 11a_100000744171_100015343762 [0,1,0,0,0,1|1,0,1]=4 1904 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 1626a_100000744171_100015343762 [0,1,0,0,0,1|1,0,1]=4 1905 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 240690a_100000744171_100015343762 [0,1,0,0,0,1|1,0,1]=4 1906 B16R2.11587 CC(=O)N[C@H](C)c1ccc2c(c1)OCO2 527a_100000744171_100103153847 [0,1,0,0,0,1|1,0,1]=4 1907 B16R2.11587 CC(C)CC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100000210624 [0,1,0,0,0,1|2,0,0]=4 1908 B16R2.11587 CC(C)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000210624 [0,1,0,0,0,1|1,0,0]=3 1909 B16R2.11587 CC(C)C[C@H](N)c1ccc2c(c1)CCO2 271570a_100015190218_100000729065 [0,1,0,0,0,1|2,0,0]=4 1910 B16R2.11587 CC(C)C[C@H](N)c1ccc2c(c1)OCC2 271570a_100015190218_100009818566 [0,1,0,0,0,1|2,0,0]=4 1911 B16R2.11587 CC(C)C[C@H](N)c1ccc2c(c1)OCO2 271570a_100015190218_100000688060 [0,1,0,0,0,1|1,0,0]=3 1912 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)OCO2 11a_100138425928_100000210863 [0,1,0,0,0,1|1,0,1]=4 1913 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)OCO2 1626a_100138425928_100000210863 [0,1,0,0,0,1|1,0,1]=4 1914 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)OCO2 240690a_100138425928_100000210863 [0,1,0,0,0,1|1,0,1]=4 1915 B16R2.11587 CC(C)NC(=O)c1ccc2c(c1)OCO2 527a_100138425928_100000210863 [0,1,0,0,0,1|1,0,1]=4 1916 B16R2.11587 CC(C)NC(C)c1ccc2c(c1)CCO2 2230a_100159266031_100000210206 [0,1,0,0,0,1|2,0,0]=4 1917 B16R2.11587 CC(C)NC(C)c1ccc2c(c1)CCO2 34a_100159266031_100000210206 [0,1,0,0,0,1|2,0,0]=4 1918 B16R2.11587 CC(C)N[C@H](C)c1ccc2c(c1)OCO2 2230a_100000744171_100000210206 [0,1,0,0,0,1|1,0,0]=3 1919 B16R2.11587 CC(C)OC(C)c1ccc2c(c1)OCO2 34a_100000741967_100000210206 [0,1,0,0,0,1|1,0,0]=3 1920 B16R2.11587 CC(C)OC(C)c1ccc2c(c1)OCO2 7a_100000741967_100000210206 [0,1,0,0,0,1|1,0,0]=3 1921 B16R2.11587 CC(O)CC(=O)c1ccc2c(c1)CCO2 1458a_100011207309_100011218427 [0,1,0,0,0,1|2,0,0]=4 1922 B16R2.11587 CC(O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100011218427 [0,1,0,0,0,1|1,0,0]=3 1923 B16R2.11587 CN(C)CC(=O)c1ccc2c(c1)OCO2 269982a_100102631434_100000181162 [0,1,0,0,0,1|2,0,0]=4 1924 B16R2.11587 NC(=O)CC(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000187820 [0,1,0,0,0,1|1,0,1]=4 1925 B16R2.11587 O=C(CC(F)F)c1ccc2c(c1)OCO2 1458a_100000210863_100011934356 [0,1,0,0,0,1|2,0,0]=4 1926 B16R2.15331 CC(C)CSc1ccc2c(c1)OCC2=O 62a_100000210624_100000686717 [0,1,0,0,0,1|2,0,0]=4 1927 B16R2.15331 CC(C)CSc1ccc2c(c1)OCC2N 62a_100000210624_100020628175 [0,1,0,0,0,1|2,0,0]=4 1928 B16R2.15331 CC(C)CSc1ccc2c(c1)OCC2N 62a_100020628175_100000210760 [0,1,0,0,0,1|2,0,0]=4 1929 B16R2.15331 CC(O)CSc1ccc2c(c1)OCC2=O 62a_100011218427_100000686717 [0,1,0,0,0,1|2,0,0]=4 1930 B16R2.15331 CC(O)CSc1ccc2c(c1)OCC2N 62a_100011218427_100020628175 [0,1,0,0,0,1|2,0,0]=4 1931 B16R2.15331 CC(O)CSc1ccc2c(c1)OCC2N 62a_100020628175_100011218427 [0,1,0,0,0,1|2,0,0]=4 1932 B16R2.15331 C[C@@H](O)CSc1ccc2c(c1)OCC2=O 62a_100009817552_100000686717 [0,1,0,0,0,1|2,0,0]=4 1933 B16R2.15331 C[C@@H](O)CSc1ccc2c(c1)OCC2N 62a_100009817552_100020628175 [0,1,0,0,0,1|2,0,0]=4 1934 B16R2.15331 C[C@@H](O)CSc1ccc2c(c1)OCC2N 62a_100020628175_100009817552 [0,1,0,0,0,1|2,0,0]=4 1935 B16R2.24931 CC(C)NCc1cc(c2c(c1)CCO2)Br 207a_100138425928_100009816904 [0,1,0,0,0,1|2,0,0]=4 1936 B16R2.24931 CC(C)NCc1cc(c2c(c1)OCO2)Br 207a_100138425928_100000682445 [0,1,0,0,0,1|1,0,0]=3 1937 B16R2.24931 CC(C)NCc1cc(c2c(c1)OCO2)Cl 207a_100138425928_100000016197 [0,1,0,0,0,1|1,0,0]=3 1938 B16R2.24931 CC(C)OCc1cc(c2c(c1)OCO2)Cl 34a_100000198975_100000210206 [0,1,0,0,0,1|1,0,0]=3 1939 B16R2.24931 CC(C)OCc1cc(c2c(c1)OCO2)Cl 7a_100000198975_100000210206 [0,1,0,0,0,1|1,0,0]=3 1940 B16R2.82843 CC(C)(C)C=Cc1ccc2c(c1)OCO2 271570a_100102527731_100000688060 [0,1,0,0,0,1|1,0,1]=4 1941 B16R2.82843 CC(C)(C)CNc1ccc2c(c1)CCO2 34a_100000736984_100011219605 [0,1,0,0,0,1|2,0,0]=4 1942 B16R2.82843 CC(C)(C)CNc1ccc2c(c1)OCO2 34a_100000209953_100011219605 [0,1,0,0,0,1|1,0,0]=3 1943 B16R2.82843 CC(C)(C)COc1ccc2c(c1)OCO2 34a_100000210298_100011219605 [0,1,0,0,0,1|1,0,0]=3 1944 B16R2.82843 CC(C)(C)CSc1ccc2c(c1)CCO2 62a_100000729065_100011219605 [0,1,0,0,0,1|2,0,0]=4 1945 B16R2.82843 CC(C)(C)CSc1ccc2c(c1)CCO2 62a_100011219605_100000729065 [0,1,0,0,0,1|2,0,0]=4 1946 B16R2.82843 CC(C)(C)CSc1ccc2c(c1)OCC2 62a_100009818566_100011219605 [0,1,0,0,0,1|2,0,0]=4 1947 B16R2.82843 CC(C)(C)CSc1ccc2c(c1)OCC2 62a_100011219605_100009818566 [0,1,0,0,0,1|2,0,0]=4 1948 B16R2.82843 CC(C)(C)NCc1ccc2c(c1)CCO2 207a_100000715429_100011218456 [0,1,0,0,0,1|2,0,0]=4 1949 B16R2.82843 CC(C)(C)NCc1ccc2c(c1)CCO2 34a_100011219410_100000210625 [0,1,0,0,0,1|2,0,0]=4 1950 B16R2.82843 CC(C)(C)NCc1ccc2c(c1)OCO2 34a_100000210006_100000210625 [0,1,0,0,0,1|1,0,0]=3 1951 B16R2.82843 CC(C)(C)OCc1ccc2c(c1)CCO2 34a_100011219353_100000210625 [0,1,0,0,0,1|2,0,0]=4 1952 B16R2.82843 CC(C)(C)OCc1ccc2c(c1)OCO2 34a_100000210967_100000210625 [0,1,0,0,0,1|1,0,0]=3 1953 B16R2.82843 CC(C)(C)OCc1ccc2c(c1)OCO2 34a_100015890283_100000189651 [0,1,0,0,0,1|1,0,0]=3 1954 B16R2.82843 CC(C)(C)OCc1ccc2c(c1)OCO2 7a_100015890283_100000189651 [0,1,0,0,0,1|1,0,0]=3 1955 B16R2.82843 CC(C)(F)CNc1ccc2c(c1)CCO2 34a_100000736984_100011997219 [0,1,0,0,0,1|2,0,0]=4 1956 B16R2.82843 CC(C)(F)CNc1ccc2c(c1)OCO2 34a_100000209953_100011997219 [0,1,0,0,0,1|1,0,0]=3 1957 B16R2.82843 CC(C)(F)COc1ccc2c(c1)OCO2 34a_100000210298_100011997219 [0,1,0,0,0,1|1,0,0]=3 1958 B16R2.82843 CC(C)(F)CSc1ccc2c(c1)CCO2 62a_100000729065_100011997219 [0,1,0,0,0,1|2,0,0]=4 1959 B16R2.82843 CC(C)(F)CSc1ccc2c(c1)CCO2 62a_100011997219_100000729065 [0,1,0,0,0,1|2,0,0]=4 1960 B16R2.82843 CC(C)(F)CSc1ccc2c(c1)OCC2 62a_100009818566_100011997219 [0,1,0,0,0,1|2,0,0]=4 1961 B16R2.82843 CC(C)(F)CSc1ccc2c(c1)OCC2 62a_100011997219_100009818566 [0,1,0,0,0,1|2,0,0]=4 1962 B16R2.82843 CC(C)(O)C=Cc1ccc2c(c1)OCO2 271570a_200016258132_100000688060 [0,1,0,0,0,1|1,0,1]=4 1963 B16R2.82843 CC(C)(O)CNc1ccc2c(c1)CCO2 34a_100000736984_100000764493 [0,1,0,0,0,1|2,0,0]=4 1964 B16R2.82843 CC(C)(O)CNc1ccc2c(c1)OCO2 34a_100000209953_100000764493 [0,1,0,0,0,1|1,0,0]=3 1965 B16R2.82843 CC(C)(O)COc1ccc2c(c1)OCO2 34a_100000210298_100000764493 [0,1,0,0,0,1|1,0,0]=3 1966 B16R2.82843 CC(C)(O)CSc1ccc2c(c1)CCO2 62a_100000729065_100000764493 [0,1,0,0,0,1|2,0,0]=4 1967 B16R2.82843 CC(C)(O)CSc1ccc2c(c1)CCO2 62a_100000764493_100000729065 [0,1,0,0,0,1|2,0,0]=4 1968 B16R2.82843 CC(C)(O)CSc1ccc2c(c1)OCC2 62a_100000764493_100009818566 [0,1,0,0,0,1|2,0,0]=4 1969 B16R2.82843 CC(C)(O)CSc1ccc2c(c1)OCC2 62a_100009818566_100000764493 [0,1,0,0,0,1|2,0,0]=4 1970 B16R2.82843 CS(=O)(=O)NCc1ccc2c(c1)OCO2 40a_100000210006_100000738038 [0,1,0,0,0,1|2,0,0]=4 1971 B16R2.82843 C[Si](C)(C)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000037933 [0,1,0,0,0,1|1,1,0]=4 1972 B16R2.82843 FC(F)(F)CNc1ccc2c(c1)OCO2 2230a_100000209953_100000763148 [0,1,0,0,0,1|2,0,0]=4 1973 B16R2.82843 FC(F)(F)NCc1ccc2c(c1)OCO2 34a_100000210006_200103152311 [0,1,0,0,0,1|2,0,0]=4 1974 B16R2.82843 FC(F)(F)OCc1ccc2c(c1)OCO2 34a_100000210967_200103152311 [0,1,0,0,0,1|2,0,0]=4 1975 B16R2.83537 C=C(C)CSc1ccc2c(c1C)OCO2 62a_100010335860_100000211660 [0,1,0,0,0,1|1,0,1]=4 1976 B16R2.83537 C=C(C)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000211660 [0,1,0,0,0,1|1,0,1]=4 1977 B16R2.83537 CC(C)C=Cc1ccc2c(c1F)OCO2 271570a_100016257149_100010223184 [0,1,0,0,0,1|1,0,1]=4 1978 B16R2.83537 CC(C)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000210760 [0,1,0,0,0,1|1,0,0]=3 1979 B16R2.83537 CC(O)C=Cc1ccc2c(c1F)OCO2 271570a_200011019289_100010223184 [0,1,0,0,0,1|1,0,1]=4 1980 B16R2.83537 CC(O)CSc1ccc2c(c1F)OCO2 62a_100010223184_100011218427 [0,1,0,0,0,1|1,0,0]=3 1981 B16R2.83537 C[C@@H](O)CSc1ccc2c(c1F)OCO2 62a_100010223184_100009817552 [0,1,0,0,0,1|1,0,0]=3 1982 B16R2.83537 Cc1c(ccc2c1OCO2)C=CC(C)C 271570a_100016257149_100010335860 [0,1,0,0,0,1|1,0,1]=4 1983 B16R2.83537 Cc1c(ccc2c1OCO2)C=CC(C)O 271570a_200011019289_100010335860 [0,1,0,0,0,1|1,0,1]=4 1984 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(=O)N 62a_100010335860_100000747473 [0,1,0,0,0,1|1,0,1]=4 1985 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(C)C 62a_100010335860_100000210760 [0,1,0,0,0,1|1,0,0]=3 1986 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(C)O 62a_100010335860_100011218427 [0,1,0,0,0,1|1,0,0]=3 1987 B16R2.83537 Cc1c(ccc2c1OCO2)SCC(F)F 62a_100010335860_100011934356 [0,1,0,0,0,1|2,0,0]=4 1988 B16R2.83537 Cc1c(ccc2c1OCO2)SC[C@@H](C)O 62a_100010335860_100009817552 [0,1,0,0,0,1|1,0,0]=3 1989 B16R2.83537 Fc1c(ccc2c1OCO2)SCC(F)F 62a_100010223184_100011934356 [0,1,0,0,0,1|2,0,0]=4 1990 B16R2.83537 NC(=O)CSc1ccc2c(c1F)OCO2 62a_100010223184_100000747473 [0,1,0,0,0,1|1,0,1]=4 1991 B16R2.97934 CC(C)CSc1ccc2c(c1)C(=O)CO2 62a_100000210624_100000752586 [0,1,0,0,0,1|2,0,0]=4 1992 B16R2.97934 CC(O)CSc1ccc2c(c1)C(=O)CO2 62a_100011218427_100000752586 [0,1,0,0,0,1|2,0,0]=4 1993 B16R2.97934 C[C@@H](O)CSc1ccc2c(c1)C(=O)CO2 62a_100009817552_100000752586 [0,1,0,0,0,1|2,0,0]=4 1994 B16R2.34999 CC(=O)Cc1ccc2c(c1)OC(O2)(F)F 1458a_100000070787_100000729791 [0,2,0,0,0,0|1,0,1]=4 1995 B16R2.34999 CC(=O)Cc1ccc2c(c1)OC(O2)(F)F 1458a_100010217527_200000210301 [0,2,0,0,0,0|1,0,1]=4 1996 B16R2.34999 CC(C)Nc1ccc2c(c1)OC(O2)(C)C 2230a_100000217601_100000210206 [0,2,0,0,0,0|2,0,0]=4 1997 B16R2.34999 CC(C)Nc1ccc2c(c1)OC(O2)(C)C 34a_100000217601_100000210206 [0,2,0,0,0,0|2,0,0]=4 1998 B16R2.34999 CC(C)Nc1ccc2c(c1)OC(O2)(C)C 7a_100000217601_100000210206 [0,2,0,0,0,0|2,0,0]=4 1999 B16R2.34999 CC(C)Nc1ccc2c(c1)OC(O2)(F)F 2230a_100000205996_100000210206 [0,2,0,0,0,0|2,0,0]=4 2000 B16R2.34999 CC(C)Nc1ccc2c(c1)OC(O2)(F)F 34a_100000205996_100000210206 [0,2,0,0,0,0|2,0,0]=4 2001 B16R2.34999 CC(C)Sc1ccc2c(c1)OC(O2)(C)C 62a_100000210206_100010187540 [0,2,0,0,0,0|2,0,0]=4 2002 B16R2.34999 CC(C)Sc1ccc2c(c1)OC(O2)(F)F 62a_100000210206_100009813929 [0,2,0,0,0,0|2,0,0]=4 2003 B16R2.34999 CN(C)Cc1ccc2c(c1)OC(O2)(F)F 2230a_100102631434_100000729791 [0,2,0,0,0,0|2,0,0]=4 2004 B16R2.34999 CN(C)Cc1ccc2c(c1)OC(O2)(F)F 269982a_100102631434_100000729791 [0,2,0,0,0,0|2,0,0]=4 2005 B16R2.34999 CN(C)Cc1ccc2c(c1)OC(O2)(F)F 270004a_100102631434_100000043063 [0,2,0,0,0,0|2,0,0]=4 2006 B16R2.34999 [13CH3]C(=O)Cc1ccc2c(c1)OC(O2)(F)F 1458a_100010217527_200025704644 [0,2,0,0,0,0|1,0,1]=4 2007 B16R2.1579 CC(C)Sc1cc2c(cc1C=O)OCO2 62a_100000186749_100000210206 [0,2,0,0,0,0|2,0,0]=4 2008 B16R2.1579 CC(C)Sc1cc2c(cc1CN)OCO2 62a_200011199097_100000210206 [0,2,0,0,0,0|2,0,0]=4 2009 B16R2.1579 CC(C)Sc1cc2c(cc1CO)OCO2 62a_100000187691_100000210206 [0,2,0,0,0,0|2,0,0]=4 2010 B16R2.1579 COc1cc2c(cc1CN(C)C)OCO2 270004a_100102631434_100000186743 [0,2,0,0,0,0|2,0,0]=4 2011 B16R2.1579 COc1cc2c(cc1NC(C)C)OCO2 2230a_200000088178_100000210206 [0,2,0,0,0,0|2,0,0]=4 2012 B16R2.1579 COc1cc2c(cc1NC(C)C)OCO2 34a_200000088178_100000210206 [0,2,0,0,0,0|2,0,0]=4 2013 B16R2.3953 CC(C)C(=O)c1cc2c(cc1Br)OCO2 1458a_100012339479_100000210206 [0,2,0,0,0,0|1,0,1]=4 2014 B16R2.3956 CC(C)(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100000210625 [0,2,0,0,0,0|2,0,0]=4 2015 B16R2.3956 CC(C)(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100000210625 [0,2,0,0,0,0|2,0,0]=4 2016 B16R2.3956 CC(C)(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000211941 [0,2,0,0,0,0|2,0,0]=4 2017 B16R2.3956 Cc1cc2c(cc1NC(C)(C)C)OCO2 34a_100000066439_100000210625 [0,2,0,0,0,0|2,0,0]=4 2018 B16R2.3956 Cc1cc2c(cc1OC(C)(C)C)OCO2 34a_100000145572_100000210625 [0,2,0,0,0,0|2,0,0]=4 2019 B16R2.34310 C#CC(C)Nc1cc2c(cc1C)OCO2 34a_100000066439_200000035995 [0,2,0,0,0,0|2,0,0]=4 2020 B16R2.34310 C#CC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_200000035995 [0,2,0,0,0,0|2,0,0]=4 2021 B16R2.34310 C#CC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_200000035995 [0,2,0,0,0,0|2,0,0]=4 2022 B16R2.34310 C#CC(C)Oc1cc2c(cc1C)OCO2 34a_100000145572_200000035995 [0,2,0,0,0,0|2,0,0]=4 2023 B16R2.34310 CC(C#N)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000703298 [0,2,0,0,0,0|1,0,1]=4 2024 B16R2.34310 CC(C#N)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000703298 [0,2,0,0,0,0|1,0,1]=4 2025 B16R2.34310 CC(CO)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100012180447 [0,2,0,0,0,0|2,0,0]=4 2026 B16R2.34310 CC(CO)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100012180447 [0,2,0,0,0,0|2,0,0]=4 2027 B16R2.34310 CC(CO)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100012180447 [0,2,0,0,0,0|2,0,0]=4 2028 B16R2.34310 CCC(=O)Cc1cc2c(cc1Br)OCO2 1458a_100000210414_100009995336 [0,2,0,0,0,0|1,0,1]=4 2029 B16R2.34310 CCC(=O)Cc1cc2c(cc1Cl)OCO2 1458a_100000210414_100000043460 [0,2,0,0,0,0|1,0,1]=4 2030 B16R2.34310 CCC(C)Nc1cc2c(cc1C)OCO2 2230a_100000066439_100000758301 [0,2,0,0,0,0|2,0,0]=4 2031 B16R2.34310 CCC(C)Nc1cc2c(cc1C)OCO2 34a_100000066439_100011215416 [0,2,0,0,0,0|2,0,0]=4 2032 B16R2.34310 CCC(C)Nc1cc2c(cc1Cl)OCO2 34a_100000234339_100011215416 [0,2,0,0,0,0|2,0,0]=4 2033 B16R2.34310 CCC(C)Oc1cc2c(cc1Br)OCO2 34a_100010290809_100011215416 [0,2,0,0,0,0|2,0,0]=4 2034 B16R2.34310 CCC(C)Oc1cc2c(cc1Br)OCO2 7a_100010290809_100000758301 [0,2,0,0,0,0|2,0,0]=4 2035 B16R2.34310 CCC(C)Oc1cc2c(cc1C)OCO2 34a_100000145572_100011215416 [0,2,0,0,0,0|2,0,0]=4 2036 B16R2.34310 CCC(C)Oc1cc2c(cc1C)OCO2 7a_100000145572_100000758301 [0,2,0,0,0,0|2,0,0]=4 2037 B16R2.34310 CCC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100000758301 [0,2,0,0,0,0|2,0,0]=4 2038 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 2230a_100000225621_100009995336 [0,2,0,0,0,0|2,0,0]=4 2039 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 269982a_100000225621_100009995336 [0,2,0,0,0,0|2,0,0]=4 2040 B16R2.34310 CCN(C)Cc1cc2c(cc1Br)OCO2 26a_100000225621_100010290809 [0,2,0,0,0,0|2,0,0]=4 2041 B16R2.34310 CCN(C)Cc1cc2c(cc1C)OCO2 269982a_100000225621_200000112958 [0,2,0,0,0,0|2,0,0]=4 2042 B16R2.34310 CCN(C)Cc1cc2c(cc1Cl)OCO2 269982a_100000225621_100000043460 [0,2,0,0,0,0|2,0,0]=4 2043 B16R2.34310 COC(C)Sc1cc2c(cc1N)OCO2 62a_100012557033_100009879195 [0,2,0,0,0,0|2,0,0]=4 2044 B16R2.34310 C[C@H](CO)Sc1cc2c(cc1N)OCO2 62a_100012557033_100016084084 [0,2,0,0,0,0|2,0,0]=4 2045 B16R2.34310 Cc1cc2c(cc1NC(C)C#N)OCO2 2230a_100000066439_100000184139 [0,2,0,0,0,0|1,0,1]=4 2046 B16R2.34310 Cc1cc2c(cc1NC(C)CO)OCO2 2230a_100000066439_100012180447 [0,2,0,0,0,0|2,0,0]=4 2047 B16R2.34310 Cc1cc2c(cc1NC(C)CO)OCO2 34a_100000066439_100012180447 [0,2,0,0,0,0|2,0,0]=4 2048 B16R2.34310 Cc1cc2c(cc1OC(C)C#N)OCO2 7a_100000145572_100000703298 [0,2,0,0,0,0|1,0,1]=4 2049 B16R2.34310 Cc1cc2c(cc1OC(C)CO)OCO2 34a_100000145572_100012180447 [0,2,0,0,0,0|2,0,0]=4 2050 B16R2.34310 Cc1cc2c(cc1OC(C)CO)OCO2 7a_100000145572_100012180447 [0,2,0,0,0,0|2,0,0]=4 2051 B16R2.34310 O=C(CO)Cc1cc2c(cc1Br)OCO2 1458a_100000210174_100009995336 [0,2,0,0,0,0|1,0,1]=4 2052 B16R2.34310 O=C(CO)Cc1cc2c(cc1Cl)OCO2 1458a_100000210174_100000043460 [0,2,0,0,0,0|1,0,1]=4 2053 B16R2.2183 C#CC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_200000035995 [0,2,0,0,0,0|1,0,1]=4 2054 B16R2.2183 CC(C#N)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000703298 [0,2,0,0,0,0|0,0,2]=4 2055 B16R2.2183 CCC(=O)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_100000210202 [0,2,0,0,0,0|1,0,1]=4 2056 B16R2.2183 CCC(C)C(=O)c1ccc2c(c1)OCO2 1458a_100000210863_100000758301 [0,2,0,0,0,0|1,0,1]=4 2057 B16R2.2183 CNC(=O)C(O)c1ccc2c(c1)OCO2 240690a_100102657272_200011216465 [0,2,0,0,0,0|1,0,1]=4 2058 B16R2.2183 O=C(CF)C(O)c1ccc2c(c1)OCO2 1458a_200011216465_100015361967 [0,2,0,0,0,0|1,0,1]=4 2059 B16R2.5480 CCN(c1ccc2c(c1)OCO2)C(C)C 2230a_200000219546_100000210206 [0,2,0,0,0,0|2,0,0]=4 2060 B16R2.5480 CCN(c1ccc2c(c1)OCO2)C(C)C 269982a_200000219546_100000210206 [0,2,0,0,0,0|2,0,0]=4 2061 B16R2.5480 CCN(c1ccc2c(c1)OCO2)C(C)C 34a_200000219546_100000210206 [0,2,0,0,0,0|2,0,0]=4 2062 B16R2.5480 CNC(C(=O)N)c1ccc2c(c1)OCO2 7a_106832991635_100000069277 [0,2,0,0,0,0|1,0,1]=4 2063 B16R2.5480 CSC(C(=O)N)c1ccc2c(c1)OCO2 62a_100000069277_200000210301 [0,2,0,0,0,0|1,0,1]=4 2064 B16R2.5480 [13CH3]SC(C(=O)N)c1ccc2c(c1)OCO2 62a_100000069277_200025704644 [0,2,0,0,0,0|1,0,1]=4 2065 B16R2.15953 Cc1c(ccc2c1OCO2)C(=O)C(C)C 1458a_100009908537_100000210206 [0,2,0,0,0,0|1,0,1]=4 2066 B16R2.24930 CC(C)C(=O)c1cc(c2c(c1)OCO2)Br 1458a_100000744664_100000210206 [0,2,0,0,0,0|1,0,1]=4 2067 B16R2.2151 C#CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000184674 [0,2,0,0,0,0|1,0,1]=4 2068 B16R2.2151 C#CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000038162 [0,2,0,0,0,0|2,0,0]=4 2069 B16R2.2151 C#CCN(C)Cc1ccc2c(c1)OCO2 34a_100000225692_100000189651 [0,2,0,0,0,0|2,0,0]=4 2070 B16R2.2151 C=CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210623 [0,2,0,0,0,0|1,0,1]=4 2071 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210623 [0,2,0,0,0,0|2,0,0]=4 2072 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210623 [0,2,0,0,0,0|2,0,0]=4 2073 B16R2.2151 C=CCN(C)Cc1ccc2c(c1)OCO2 269982a_100000225617_100000189651 [0,2,0,0,0,0|2,0,0]=4 2074 B16R2.2151 CC(CC#N)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009813641 [0,2,0,0,0,0|1,0,1]=4 2075 B16R2.2151 CC(CCO)Nc1ccc2c(c1)OCO2 2230a_100000209953_100009893172 [0,2,0,0,0,0|2,0,0]=4 2076 B16R2.2151 CC(CCO)Nc1ccc2c(c1)OCO2 34a_100000209953_100009893172 [0,2,0,0,0,0|2,0,0]=4 2077 B16R2.2151 CC(CCO)Oc1ccc2c(c1)OCO2 34a_100000210298_100009893172 [0,2,0,0,0,0|2,0,0]=4 2078 B16R2.2151 CCCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000210303 [0,2,0,0,0,0|1,0,1]=4 2079 B16R2.2151 CCCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000766640 [0,2,0,0,0,0|2,0,0]=4 2080 B16R2.2151 CCCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000766640 [0,2,0,0,0,0|2,0,0]=4 2081 B16R2.2151 CCCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000766640 [0,2,0,0,0,0|2,0,0]=4 2082 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000210303 [0,2,0,0,0,0|2,0,0]=4 2083 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000210303 [0,2,0,0,0,0|2,0,0]=4 2084 B16R2.2151 CCCN(C)Cc1ccc2c(c1)OCO2 269982a_100000747261_100000189651 [0,2,0,0,0,0|2,0,0]=4 2085 B16R2.2151 CCNC(=O)Cc1ccc2c(c1)OCO2 11a_100015525214_100000743733 [0,2,0,0,0,0|1,0,1]=4 2086 B16R2.2151 CCNC(=O)Cc1ccc2c(c1)OCO2 240690a_100015525214_100000743733 [0,2,0,0,0,0|1,0,1]=4 2087 B16R2.2151 CCNC(=O)Cc1ccc2c(c1)OCO2 527a_100015525214_100000743733 [0,2,0,0,0,0|1,0,1]=4 2088 B16R2.2151 CN(CC#N)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011215382 [0,2,0,0,0,0|1,0,1]=4 2089 B16R2.2151 CN(CC#N)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011214920 [0,2,0,0,0,0|1,0,1]=4 2090 B16R2.2151 CN(CC=O)Cc1ccc2c(c1)OCO2 2230a_100000186720_200015260668 [0,2,0,0,0,0|2,0,0]=4 2091 B16R2.2151 CN(CC=O)Cc1ccc2c(c1)OCO2 269982a_100000186720_200015260668 [0,2,0,0,0,0|2,0,0]=4 2092 B16R2.2151 CN(CCF)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011217306 [0,2,0,0,0,0|2,0,0]=4 2093 B16R2.2151 CN(CCF)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011217306 [0,2,0,0,0,0|2,0,0]=4 2094 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000211926 [0,2,0,0,0,0|2,0,0]=4 2095 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000211926 [0,2,0,0,0,0|2,0,0]=4 2096 B16R2.2151 CN(CCO)Cc1ccc2c(c1)OCO2 269982a_100000210263_100000189651 [0,2,0,0,0,0|2,0,0]=4 2097 B16R2.2151 CNCC(C)Cc1ccc2c(c1)OCO2 270004a_106832991635_100000017537 [0,2,0,0,0,0|0,0,0]=2 2098 B16R2.2151 CNNC(=O)Cc1ccc2c(c1)OCO2 22a_100016993582_100000743733 [0,2,0,0,0,0|1,0,1]=4 2099 B16R2.2151 COCC(C)Nc1ccc2c(c1)OCO2 2230a_100000209953_100000765312 [0,2,0,0,0,0|2,0,0]=4 2100 B16R2.2151 COCC(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000765312 [0,2,0,0,0,0|2,0,0]=4 2101 B16R2.2151 COCC(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000765312 [0,2,0,0,0,0|2,0,0]=4 2102 B16R2.2151 COCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100000766300 [0,2,0,0,0,0|2,0,0]=4 2103 B16R2.2151 COCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100000766300 [0,2,0,0,0,0|2,0,0]=4 2104 B16R2.2151 CSCN(C)Cc1ccc2c(c1)OCO2 2230a_100000186720_100011218213 [0,2,0,0,0,0|2,0,0]=4 2105 B16R2.2151 CSCN(C)Cc1ccc2c(c1)OCO2 269982a_100000186720_100011218213 [0,2,0,0,0,0|2,0,0]=4 2106 B16R2.2151 N#CCC(=O)Cc1ccc2c(c1)OCO2 1458a_100000743733_100011214920 [0,2,0,0,0,0|1,0,1]=4 2107 B16R2.2151 O=C(CCF)Cc1ccc2c(c1)OCO2 1458a_100000743733_100011217306 [0,2,0,0,0,0|1,0,1]=4 2108 B16R2.2151 O=C(CCO)Cc1ccc2c(c1)OCO2 1458a_100000743733_100000211926 [0,2,0,0,0,0|1,0,1]=4 2109 B16R2.6479 CC(C#N)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000703298 [0,2,0,0,0,0|1,0,1]=4 2110 B16R2.6479 CCC(C)Sc1ccc2c(c1C)OCO2 62a_100010335860_100000758301 [0,2,0,0,0,0|2,0,0]=4 2111 B16R2.6479 CCC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000758301 [0,2,0,0,0,0|2,0,0]=4 2112 B16R2.6479 COC(C)Sc1ccc2c(c1C)OCO2 62a_100010335860_100009879195 [0,2,0,0,0,0|2,0,0]=4 2113 B16R2.6479 COC(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100009879195 [0,2,0,0,0,0|2,0,0]=4 2114 B16R2.6479 C[C@H](CO)Sc1ccc2c(c1F)OCO2 62a_100010223184_100016084084 [0,2,0,0,0,0|2,0,0]=4 2115 B16R2.6479 Cc1c(ccc2c1OCO2)SC(C)C#N 62a_100010335860_100000703298 [0,2,0,0,0,0|1,0,1]=4 2116 B16R2.6479 Cc1c(ccc2c1OCO2)S[C@H](C)CO 62a_100010335860_100016084084 [0,2,0,0,0,0|2,0,0]=4 2117 B16R2.11850 CCN(CC)Cc1ccc2c(c1)OCO2 269956a_100000042499_100000189651 [0,2,0,0,0,0|2,0,0]=4 2118 B16R2.11850 CCN(CC)Cc1ccc2c(c1)OCO2 269982a_100000724800_100000189651 [0,2,0,0,0,0|2,0,0]=4 2119 B16R2.21744 C#CC(C)(C)Nc1ccc2c(c1)OCO2 34a_100000209953_100000038118 [0,2,0,0,0,0|2,0,0]=4 2120 B16R2.21744 C#CC(C)(C)Oc1ccc2c(c1)OCO2 34a_100000210298_100000038118 [0,2,0,0,0,0|2,0,0]=4 2121 B16R2.21744 CC(C)(C#N)Nc1ccc2c(c1)OCO2 34a_100000209953_100011162410 [0,2,0,0,0,0|1,0,1]=4 2122 B16R2.21744 CC(C)(C#N)Oc1ccc2c(c1)OCO2 34a_100000210298_100011162410 [0,2,0,0,0,0|1,0,1]=4 2123 B16R2.83540 CC(C)(C)Sc1ccc2c(c1F)OCO2 62a_100010223184_100000211941 [0,2,0,0,0,0|2,0,0]=4 2124 B16R2.83540 Cc1c(ccc2c1OCO2)SC(C)(C)C 62a_100010335860_100000211941 [0,2,0,0,0,0|2,0,0]=4 2125 B16R2.9265 CC(C)Sc1ccc2c(c1C=O)OCO2 62a_100009816621_100000210206 [0,2,0,0,0,0|2,0,0]=4 2126 B14R2.3063 COc1ccc(cc1O)NC2CC2 34a_100000211920_100000211595 [0,0,1,1,0,0|2,0,0]=4 2127 B14R2.3168 COc1cc(ccc1O)NC2CC2 34a_100000726020_100000211595 [0,0,1,1,0,0|2,0,0]=4 2128 B14R2.96 CCSc1ccc(cc1)C2CC2N 62a_100000210202_100000755575 [0,0,1,1,0,0|1,1,0]=4 2129 B14R2.96 CCSc1ccc(cc1)C2CC2N 62a_100000755575_100000210202 [0,0,1,1,0,0|1,1,0]=4 2130 B14R2.96 NC1CC1c2ccc(cc2)SCF 62a_100000755575_100015361967 [0,0,1,1,0,0|1,1,0]=4 2131 B14R2.96 NC1CC1c2ccc(cc2)SCF 62a_100015361967_100000755575 [0,0,1,1,0,0|1,1,0]=4 2132 B14R2.9440 CC(=O)Cc1cccc2c1OCO2 1458a_100000070787_100010369185 [0,0,1,1,0,0|1,0,1]=4 2133 B14R2.9440 CC(C)Nc1cccc2c1OCO2 2230a_100000699912_100000210206 [0,0,1,1,0,0|2,0,0]=4 2134 B14R2.9440 CC(C)Nc1cccc2c1OCO2 34a_100000699912_100000210206 [0,0,1,1,0,0|2,0,0]=4 2135 B14R2.9440 CC(C)Oc1cccc2c1OCO2 34a_100000046630_100000210206 [0,0,1,1,0,0|2,0,0]=4 2136 B14R2.9440 CC(C)Oc1cccc2c1OCO2 7a_100000046630_100000210206 [0,0,1,1,0,0|2,0,0]=4 2137 B14R2.9440 CN(C)Cc1cccc2c1OCO2 269982a_100102631434_100010369185 [0,0,1,1,0,0|2,0,0]=4 2138 B14R3.3015 c1c(ncc2c1CCO2)C3CC3 271570a_100011220607_102495363667 [1,0,0,1,0,0|2,0,0]=4 2139 B14R3.3015 c1cc2c(cc1C3CC3)CCC2 271570a_100011220607_100000745594 [1,0,0,1,0,0|2,0,0]=4 2140 B14R3.3015 c1cc2c(cc1C3CC3)CCN2 271570a_100011220607_100000026929 [1,0,0,1,0,0|2,0,0]=4 2141 B14R3.3015 c1cc2c(cc1C3CC3)CCO2 271570a_100011220607_100000729065 [1,0,0,1,0,0|1,0,0]=3 2142 B14R3.3015 c1cc2c(cc1C3CC3)NCC2 271570a_100011220607_100000754641 [1,0,0,1,0,0|2,0,0]=4 2143 B14R3.3015 c1cc2c(cc1C3CC3)OCC2 271570a_100011220607_100009818566 [1,0,0,1,0,0|1,0,0]=3 2144 B14R3.3015 c1cc2c(cc1C3CC3)OCO2 271570a_100011220607_100000688060 [1,0,0,1,0,0|0,0,0]=2 2145 B14R3.3015 c1cc2cc(ccc2o1)C3CC3 271570a_100011220607_100012343831 [1,0,0,1,0,0|1,0,1]=4 2146 B14R3.3015 c1cc2ccc(cc2o1)C3CC3 271570a_100011220607_100000759542 [1,0,0,1,0,0|1,0,1]=4 2147 B14R3.3015 c1cc2cnoc2cc1C3CC3 271570a_100011220607_100009817722 [1,0,0,1,0,0|2,0,0]=4 2148 B14R3.3015 c1cc2oncc2cc1C3CC3 271570a_100011220607_100009817723 [1,0,0,1,0,0|2,0,0]=4 2149 B14R3.3015 c1nc2cc(ccc2o1)C3CC3 271570a_100011220607_100009816175 [1,0,0,1,0,0|1,0,1]=4 2150 B14R3.3015 c1nc2ccc(cc2o1)C3CC3 271570a_100011220607_100009817590 [1,0,0,1,0,0|1,0,1]=4 2151 B16R3.63903 c1cc2c(cc1NC3CC3)OCCO2 34a_100020630400_100000211595 [0,0,0,1,0,1|2,0,0]=4 2152 B16R3.63903 c1cc2c(cc1OC3CC3)OCCO2 34a_100000234341_100000211595 [0,0,0,1,0,1|2,0,0]=4 2153 B16R3.63903 c1cc2c(cc1SC3CC3)OCCO2 62a_100011216881_100000211595 [0,0,0,1,0,1|2,0,0]=4 2154 B16R3.6439 C(#CC1CC1)c2ccc3c(c2)OCO3 271570a_200009880635_100000688060 [0,0,0,1,0,1|1,0,1]=4 2155 B16R3.6439 C(=CC1CC1)c2ccc3c(c2)OCO3 271570a_100102526188_100000688060 [0,0,0,1,0,1|1,0,1]=4 2156 B16R3.6439 c1cc2c(cc1CNC3CC3)CCO2 34a_100011219410_100000211595 [0,0,0,1,0,1|2,0,0]=4 2157 B16R3.6439 c1cc2c(cc1CNC3CC3)OCO2 34a_100000210006_100000211595 [0,0,0,1,0,1|1,0,0]=3 2158 B16R3.6439 c1cc2c(cc1CNC3CC3)OCO2 34a_100000212008_100000189651 [0,0,0,1,0,1|1,0,0]=3 2159 B16R3.6439 c1cc2c(cc1COC3CC3)CCO2 34a_100011219353_100000211595 [0,0,0,1,0,1|2,0,0]=4 2160 B16R3.6439 c1cc2c(cc1COC3CC3)OCO2 34a_100000210967_100000211595 [0,0,0,1,0,1|1,0,0]=3 2161 B16R3.6439 c1cc2c(cc1NCC3CC3)CCO2 2230a_100000736984_100000742324 [0,0,0,1,0,1|2,0,0]=4 2162 B16R3.6439 c1cc2c(cc1NCC3CC3)CCO2 34a_100000736984_100000742324 [0,0,0,1,0,1|2,0,0]=4 2163 B16R3.6439 c1cc2c(cc1NCC3CC3)OCO2 2230a_100000209953_100000742324 [0,0,0,1,0,1|1,0,0]=3 2164 B16R3.6439 c1cc2c(cc1NCC3CC3)OCO2 34a_100000209953_100000742324 [0,0,0,1,0,1|1,0,0]=3 2165 B16R3.6439 c1cc2c(cc1NCC3CO3)CCO2 2230a_100000736984_100011216344 [0,0,0,1,0,1|2,0,0]=4 2166 B16R3.6439 c1cc2c(cc1NCC3CO3)CCO2 34a_100000736984_102125554688 [0,0,0,1,0,1|2,0,0]=4 2167 B16R3.6439 c1cc2c(cc1NCC3CO3)OCO2 2230a_100000209953_100011216344 [0,0,0,1,0,1|1,0,0]=3 2168 B16R3.6439 c1cc2c(cc1NCC3CO3)OCO2 34a_100000209953_102125554688 [0,0,0,1,0,1|1,0,0]=3 2169 B16R3.6439 c1cc2c(cc1OCC3CC3)OCO2 34a_100000210298_100000742324 [0,0,0,1,0,1|1,0,0]=3 2170 B16R3.6439 c1cc2c(cc1OCC3CO3)OCO2 34a_100000210298_102125554688 [0,0,0,1,0,1|1,0,0]=3 2171 B16R3.6439 c1cc2c(cc1SCC3CC3)CCO2 62a_100000729065_100000742324 [0,0,0,1,0,1|2,0,0]=4 2172 B16R3.6439 c1cc2c(cc1SCC3CC3)CCO2 62a_100000756562_100000729065 [0,0,0,1,0,1|2,0,0]=4 2173 B16R3.6439 c1cc2c(cc1SCC3CC3)OCC2 62a_100000756562_100009818566 [0,0,0,1,0,1|2,0,0]=4 2174 B16R3.6439 c1cc2c(cc1SCC3CC3)OCC2 62a_100009818566_100000742324 [0,0,0,1,0,1|2,0,0]=4 2175 B16R3.6439 c1cc2c(cc1SCC3CO3)CCO2 62a_100000729065_102125554688 [0,0,0,1,0,1|2,0,0]=4 2176 B16R3.6439 c1cc2c(cc1SCC3CO3)CCO2 62a_102125554688_100000729065 [0,0,0,1,0,1|2,0,0]=4 2177 B16R3.6439 c1cc2c(cc1SCC3CO3)OCC2 62a_100009818566_102125554688 [0,0,0,1,0,1|2,0,0]=4 2178 B16R3.6439 c1cc2c(cc1SCC3CO3)OCC2 62a_102125554688_100009818566 [0,0,0,1,0,1|2,0,0]=4 2179 B16R3.6439 c1cc2c(cc1SCC3CS3)CCO2 62a_100000031435_100000729065 [0,0,0,1,0,1|2,0,0]=4 2180 B16R3.6439 c1cc2c(cc1SCC3CS3)CCO2 62a_100000729065_100000031435 [0,0,0,1,0,1|2,0,0]=4 2181 B16R3.6439 c1cc2c(cc1SCC3CS3)OCC2 62a_100000031435_100009818566 [0,0,0,1,0,1|2,0,0]=4 2182 B16R3.6439 c1cc2c(cc1SCC3CS3)OCC2 62a_100009818566_100000031435 [0,0,0,1,0,1|2,0,0]=4 2183 B16R3.6439 c1cc2c(cc1SC[C@@H]3CO3)CCO2 62a_100000729065_100000745022 [0,0,0,1,0,1|2,0,0]=4 2184 B16R3.6439 c1cc2c(cc1SC[C@@H]3CO3)CCO2 62a_100000745022_100000729065 [0,0,0,1,0,1|2,0,0]=4 2185 B16R3.6439 c1cc2c(cc1SC[C@@H]3CO3)OCC2 62a_100000745022_100009818566 [0,0,0,1,0,1|2,0,0]=4 2186 B16R3.6439 c1cc2c(cc1SC[C@@H]3CO3)OCC2 62a_100009818566_100000745022 [0,0,0,1,0,1|2,0,0]=4 2187 B16R3.3456 Brc1cc2c(cc1OC3CC3)OCO2 34a_100010290809_100000211595 [0,1,0,1,0,0|2,0,0]=4 2188 B16R3.3456 Cc1cc2c(cc1NC3CC3)OCO2 34a_100000066439_100000211595 [0,1,0,1,0,0|2,0,0]=4 2189 B16R3.3456 Cc1cc2c(cc1OC3CC3)OCO2 34a_100000145572_100000211595 [0,1,0,1,0,0|2,0,0]=4 2190 B16R3.3456 Clc1cc2c(cc1NC3CC3)OCO2 34a_100000234339_100000211595 [0,1,0,1,0,0|2,0,0]=4 2191 B16R3.3456 Nc1cc2c(cc1SC3CC3)OCO2 62a_100012557033_100000211595 [0,1,0,1,0,0|2,0,0]=4 2192 B16R3.10656 C=C(c1ccc2c(c1)OCO2)C3CC3 271570a_100010895485_100000688060 [0,1,0,1,0,0|1,0,1]=4 2193 B16R3.5012 c1cc2c(cc1CN3CCC3)OCO2 269982a_100000754969_100000189651 [0,1,0,1,0,0|2,0,0]=4 2194 B16R3.5012 c1cc2c(cc1NC3CCC3)OCO2 34a_100000209953_100000749161 [0,1,0,1,0,0|2,0,0]=4 2195 B16R3.5012 c1cc2c(cc1NC3COC3)OCO2 34a_100000209953_100009818527 [0,1,0,1,0,0|2,0,0]=4 2196 B16R3.5012 c1cc2c(cc1OC3CCC3)OCO2 34a_100000210298_100000749161 [0,1,0,1,0,0|2,0,0]=4 2197 B16R3.5012 c1cc2c(cc1OC3COC3)OCO2 34a_100000210298_100009818527 [0,1,0,1,0,0|2,0,0]=4 2198 B16R3.99485 Cc1c(ccc2c1OCO2)SC3CC3 62a_100010335860_100000211595 [0,1,0,1,0,0|2,0,0]=4 2199 B16R3.99485 Fc1c(ccc2c1OCO2)SC3CC3 62a_100010223184_100000211595 [0,1,0,1,0,0|2,0,0]=4 2200 B12R1.48 C=C(C)c1ccc(c(c1)O)OC 271570a_100000694244_100009816560 [0,0,1,0,1,0|1,0,1]=4 2201 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 34a_100012182850_200025704644 [0,0,1,0,1,0|2,0,0]=4 2202 B12R1.48 CC(C)c1ccc(c(c1)Cl)O[13CH3] 7a_100012182850_200025704644 [0,0,1,0,1,0|2,0,0]=4 2203 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 34a_200000187366_200025704644 [0,0,1,0,1,0|2,0,0]=4 2204 B12R1.48 CC(C)c1ccc(c(c1)N)O[13CH3] 7a_200000187366_200025704644 [0,0,1,0,1,0|2,0,0]=4 2205 B12R1.48 COc1ccc(cc1C)C(C)C 34a_200012180908_200000210301 [0,0,1,0,1,0|2,0,0]=4 2206 B12R1.48 COc1ccc(cc1C)C(C)C 7a_200012180908_200000210301 [0,0,1,0,1,0|2,0,0]=4 2207 B12R1.48 COc1ccc(cc1Cl)C(C)C 34a_100012182850_200000210301 [0,0,1,0,1,0|2,0,0]=4 2208 B12R1.48 COc1ccc(cc1Cl)C(C)C 7a_100012182850_200000210301 [0,0,1,0,1,0|2,0,0]=4 2209 B12R1.48 COc1ccc(cc1N)C(C)C 34a_200000187366_200000210301 [0,0,1,0,1,0|2,0,0]=4 2210 B12R1.48 COc1ccc(cc1N)C(C)C 7a_200000187366_200000210301 [0,0,1,0,1,0|2,0,0]=4 2211 B12R1.48 COc1ccc(cc1O)C(=O)C 1458a_100000766810_200000210301 [0,0,1,0,1,0|1,0,1]=4 2212 B12R1.48 COc1ccc(cc1O)C(=O)C 271570a_203496583355_100000185153 [0,0,1,0,1,0|1,0,1]=4 2213 B12R1.48 COc1ccc(cc1O)C(=O)[13CH3] 1458a_100000766810_200025704644 [0,0,1,0,1,0|1,0,1]=4 2214 B12R1.48 COc1ccc(cc1O)C(C)O 271570a_203496583355_100000246541 [0,0,1,0,1,0|1,0,0]=3 2215 B12R1.48 CSc1ccc(cc1F)[C@H](C)N 62a_100134618348_200000210301 [0,0,1,0,1,0|1,1,0]=4 2216 B12R1.48 CSc1ccc(cc1F)[C@H](C)N 62a_200000210301_100134618348 [0,0,1,0,1,0|1,1,0]=4 2217 B12R1.48 C[C@H](N)c1ccc(c(c1)F)S[13CH3] 62a_100134618348_200025704644 [0,0,1,0,1,0|1,1,0]=4 2218 B12R1.48 C[C@H](N)c1ccc(c(c1)F)S[13CH3] 62a_200025704644_100134618348 [0,0,1,0,1,0|1,1,0]=4 2219 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 34a_200012180908_200025704644 [0,0,1,0,1,0|2,0,0]=4 2220 B12R1.48 Cc1cc(ccc1O[13CH3])C(C)C 7a_200012180908_200025704644 [0,0,1,0,1,0|2,0,0]=4 2221 B12R1.56 C=C(C)c1ccc(c(c1)OC)O 271570a_100000694244_100000694246 [0,0,1,0,1,0|1,0,1]=4 2222 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 34a_200000187366_200025704644 [0,0,1,0,1,0|2,0,0]=4 2223 B12R1.56 CC(C)c1ccc(c(c1)N[13CH3])O 7a_200000187366_200025704644 [0,0,1,0,1,0|2,0,0]=4 2224 B12R1.56 CNc1cc(ccc1O)C(C)C 34a_200000187366_200000210301 [0,0,1,0,1,0|2,0,0]=4 2225 B12R1.56 CNc1cc(ccc1O)C(C)C 7a_200000187366_200000210301 [0,0,1,0,1,0|2,0,0]=4 2226 B12R1.56 COc1cc(ccc1C)C(C)C 34a_100000212073_200000210301 [0,0,1,0,1,0|2,0,0]=4 2227 B12R1.56 COc1cc(ccc1C)C(C)C 7a_100000212073_200000210301 [0,0,1,0,1,0|2,0,0]=4 2228 B12R1.56 COc1cc(ccc1O)C(=O)C 1458a_100000687070_200000210301 [0,0,1,0,1,0|1,0,1]=4 2229 B12R1.56 COc1cc(ccc1O)C(=O)C 271570a_203496583355_100010110075 [0,0,1,0,1,0|1,0,1]=4 2230 B12R1.56 COc1cc(ccc1O)C(=O)N 271570a_203496583355_100009817049 [0,0,1,0,1,0|1,0,1]=4 2231 B12R1.56 COc1cc(ccc1O)C(=O)[13CH3] 1458a_100000687070_200025704644 [0,0,1,0,1,0|1,0,1]=4 2232 B12R1.56 COc1cc(ccc1O)C(C)C 271570a_203496583355_100021623167 [0,0,1,0,1,0|1,0,0]=3 2233 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_100000753309_200000210301 [0,0,1,0,1,0|1,1,0]=4 2234 B12R1.56 CSc1cc(ccc1F)[C@H](C)N 62a_200000210301_100000753309 [0,0,1,0,1,0|1,1,0]=4 2235 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_100000753309_200025704644 [0,0,1,0,1,0|1,1,0]=4 2236 B12R1.56 C[C@H](N)c1ccc(c(c1)S[13CH3])F 62a_200025704644_100000753309 [0,0,1,0,1,0|1,1,0]=4 2237 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 34a_100000212073_200025704644 [0,0,1,0,1,0|2,0,0]=4 2238 B12R1.56 Cc1ccc(cc1O[13CH3])C(C)C 7a_100000212073_200025704644 [0,0,1,0,1,0|2,0,0]=4 2239 B12R1.113 CC(C)c1ccc(cc1)OCF 34a_100000181308_100015361967 [0,0,1,0,1,0|2,0,0]=4 2240 B12R1.113 CC(C)c1ccc(cc1)OCF 7a_100000181308_100015361967 [0,0,1,0,1,0|2,0,0]=4 2241 B12R1.113 CC(O)c1ccc(cc1)OCF 34a_100000754508_100015361967 [0,0,1,0,1,0|2,0,0]=4 2242 B12R1.113 CC(O)c1ccc(cc1)OCF 7a_100000754508_100015361967 [0,0,1,0,1,0|2,0,0]=4 2243 B12R1.113 CCOc1ccc(cc1)C(C)C 34a_100000181308_100000210202 [0,0,1,0,1,0|2,0,0]=4 2244 B12R1.113 CCOc1ccc(cc1)C(C)C 7a_100000181308_100000210202 [0,0,1,0,1,0|2,0,0]=4 2245 B12R1.113 CCOc1ccc(cc1)C(C)O 34a_100000754508_100000210202 [0,0,1,0,1,0|2,0,0]=4 2246 B12R1.113 CCOc1ccc(cc1)C(C)O 7a_100000754508_100000210202 [0,0,1,0,1,0|2,0,0]=4 2247 B12R1.113 CCOc1ccc(cc1)[C@H](C)N 34a_100161106496_100000210202 [0,0,1,0,1,0|1,0,0]=3 2248 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000210202_100000720352 [0,0,1,0,1,0|1,1,0]=4 2249 B12R1.113 CCSc1ccc(cc1)[C@@H](C)N 62a_100000720352_100000210202 [0,0,1,0,1,0|1,1,0]=4 2250 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000210202_100000753911 [0,0,1,0,1,0|1,1,0]=4 2251 B12R1.113 CCSc1ccc(cc1)[C@H](C)N 62a_100000753911_100000210202 [0,0,1,0,1,0|1,1,0]=4 2252 B12R1.113 C[C@@H](N)c1ccc(cc1)SCF 62a_100000720352_100015361967 [0,0,1,0,1,0|1,1,0]=4 2253 B12R1.113 C[C@@H](N)c1ccc(cc1)SCF 62a_100015361967_100000720352 [0,0,1,0,1,0|1,1,0]=4 2254 B12R1.113 C[C@H](N)c1ccc(cc1)OCF 34a_100161106496_100015361967 [0,0,1,0,1,0|1,0,0]=3 2255 B12R1.113 C[C@H](N)c1ccc(cc1)SCF 62a_100000753911_100015361967 [0,0,1,0,1,0|1,1,0]=4 2256 B12R1.113 C[C@H](N)c1ccc(cc1)SCF 62a_100015361967_100000753911 [0,0,1,0,1,0|1,1,0]=4 2257 B12R1.279 CC(C)c1cccc(c1)OCF 34a_100000211816_100015361967 [0,0,1,0,1,0|2,0,0]=4 2258 B12R1.279 CC(C)c1cccc(c1)OCF 7a_100000211816_100015361967 [0,0,1,0,1,0|2,0,0]=4 2259 B12R1.279 CC(N)c1cccc(c1)OCF 34a_100000740644_100015361967 [0,0,1,0,1,0|1,0,0]=3 2260 B12R1.279 CC(N)c1cccc(c1)OCF 7a_100000740644_100015361967 [0,0,1,0,1,0|1,0,0]=3 2261 B12R1.279 CC(N)c1cccc(c1)SCF 62a_100015361967_100020642005 [0,0,1,0,1,0|1,1,0]=4 2262 B12R1.279 CC(N)c1cccc(c1)SCF 62a_100020642005_100015361967 [0,0,1,0,1,0|1,1,0]=4 2263 B12R1.279 CC(O)c1cccc(c1)OCF 34a_100000748013_100015361967 [0,0,1,0,1,0|2,0,0]=4 2264 B12R1.279 CC(O)c1cccc(c1)OCF 7a_100000748013_100015361967 [0,0,1,0,1,0|2,0,0]=4 2265 B12R1.279 CCOc1cccc(c1)C(C)C 34a_100000211816_100000210202 [0,0,1,0,1,0|2,0,0]=4 2266 B12R1.279 CCOc1cccc(c1)C(C)C 7a_100000211816_100000210202 [0,0,1,0,1,0|2,0,0]=4 2267 B12R1.279 CCOc1cccc(c1)C(C)N 34a_100000740644_100000210202 [0,0,1,0,1,0|1,0,0]=3 2268 B12R1.279 CCOc1cccc(c1)C(C)N 7a_100000740644_100000210202 [0,0,1,0,1,0|1,0,0]=3 2269 B12R1.279 CCOc1cccc(c1)C(C)O 34a_100000748013_100000210202 [0,0,1,0,1,0|2,0,0]=4 2270 B12R1.279 CCOc1cccc(c1)C(C)O 7a_100000748013_100000210202 [0,0,1,0,1,0|2,0,0]=4 2271 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100000210202_100020642005 [0,0,1,0,1,0|1,1,0]=4 2272 B12R1.279 CCSc1cccc(c1)C(C)N 62a_100020642005_100000210202 [0,0,1,0,1,0|1,1,0]=4 2273 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100000210202_100009818592 [1,0,0,0,1,0|2,0,0]=4 2274 B12R2.143 CCSc1ccc2c(c1)CC2 62a_100009818592_100000210202 [1,0,0,0,1,0|2,0,0]=4 2275 B12R2.143 CNCc1ccc2c(c1)CC2 207a_100102657272_100010273998 [1,0,0,0,1,0|2,0,0]=4 2276 B12R2.143 CNCc1ccc2c(c1)CC2 270004a_106832991635_100010273998 [1,0,0,0,1,0|2,0,0]=4 2277 B12R2.143 COCc1ccc2c(c1)CC2 34a_100010733339_200000210301 [1,0,0,0,1,0|2,0,0]=4 2278 B12R2.143 COCc1ccc2c(c1)CC2 7a_100010733339_200000210301 [1,0,0,0,1,0|2,0,0]=4 2279 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 34a_100010733339_200025704644 [1,0,0,0,1,0|2,0,0]=4 2280 B12R2.143 [13CH3]OCc1ccc2c(c1)CC2 7a_100010733339_200025704644 [1,0,0,0,1,0|2,0,0]=4 2281 B14R1.3653 C=C(C)CNc1ccc(c(c1)O)OC 34a_100000211920_100000748629 [0,0,1,0,0,1|1,0,1]=4 2282 B14R1.3653 C=C(C)CSc1ccc(c(c1)O)OC 62a_100000748629_100009816560 [0,0,1,0,0,1|1,0,1]=4 2283 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 207a_100138425928_100000173361 [0,0,1,0,0,1|2,0,0]=4 2284 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 2230a_100138425928_200011397701 [0,0,1,0,0,1|2,0,0]=4 2285 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 34a_100138425928_200011397701 [0,0,1,0,0,1|2,0,0]=4 2286 B14R1.3653 COc1ccc(cc1Br)CNC(C)C 34a_100159240714_100000210206 [0,0,1,0,0,1|2,0,0]=4 2287 B14R1.3653 COc1ccc(cc1Br)COC(C)C 34a_100000212225_200011397701 [0,0,1,0,0,1|2,0,0]=4 2288 B14R1.3653 COc1ccc(cc1Br)COC(C)C 34a_100000246451_100000210206 [0,0,1,0,0,1|2,0,0]=4 2289 B14R1.3653 COc1ccc(cc1Br)COC(C)C 7a_100000246451_100000210206 [0,0,1,0,0,1|2,0,0]=4 2290 B14R1.3653 COc1ccc(cc1Br)CSC(C)C 62a_100000210206_200011397701 [0,0,1,0,0,1|2,0,0]=4 2291 B14R1.3653 COc1ccc(cc1Br)CSC(C)C 62a_200011397701_100000210206 [0,0,1,0,0,1|2,0,0]=4 2292 B14R1.3653 COc1ccc(cc1Br)NCC(C)C 34a_100000187427_100000210624 [0,0,1,0,0,1|2,0,0]=4 2293 B14R1.3653 COc1ccc(cc1Br)NCC(C)O 34a_100000187427_100011218427 [0,0,1,0,0,1|2,0,0]=4 2294 B14R1.3653 COc1ccc(cc1Br)NC[C@@H](C)O 34a_100000187427_100009817552 [0,0,1,0,0,1|2,0,0]=4 2295 B14R1.3653 COc1ccc(cc1Br)OCC(C)C 34a_100010234764_100000210624 [0,0,1,0,0,1|2,0,0]=4 2296 B14R1.3653 COc1ccc(cc1Br)OCC(C)C 7a_100010234764_100000210760 [0,0,1,0,0,1|2,0,0]=4 2297 B14R1.3653 COc1ccc(cc1Br)OCC(C)O 34a_100010234764_100011218427 [0,0,1,0,0,1|2,0,0]=4 2298 B14R1.3653 COc1ccc(cc1Br)OCC(C)O 7a_100010234764_100011218427 [0,0,1,0,0,1|2,0,0]=4 2299 B14R1.3653 COc1ccc(cc1Br)OC[C@@H](C)O 34a_100010234764_100009817552 [0,0,1,0,0,1|2,0,0]=4 2300 B14R1.3653 COc1ccc(cc1Br)OC[C@@H](C)O 7a_100010234764_100009817552 [0,0,1,0,0,1|2,0,0]=4 2301 B14R1.3653 COc1ccc(cc1Br)SCC(C)C 62a_100000210624_100011249507 [0,0,1,0,0,1|2,0,0]=4 2302 B14R1.3653 COc1ccc(cc1Br)SCC(C)C 62a_100011249507_100000210760 [0,0,1,0,0,1|2,0,0]=4 2303 B14R1.3653 COc1ccc(cc1Br)SCC(C)O 62a_100011218427_100011249507 [0,0,1,0,0,1|2,0,0]=4 2304 B14R1.3653 COc1ccc(cc1Br)SCC(C)O 62a_100011249507_100011218427 [0,0,1,0,0,1|2,0,0]=4 2305 B14R1.3653 COc1ccc(cc1Br)SC[C@@H](C)O 62a_100009817552_100011249507 [0,0,1,0,0,1|2,0,0]=4 2306 B14R1.3653 COc1ccc(cc1Br)SC[C@@H](C)O 62a_100011249507_100009817552 [0,0,1,0,0,1|2,0,0]=4 2307 B14R1.3653 COc1ccc(cc1C)CNC(C)C 207a_100138425928_100000239718 [0,0,1,0,0,1|2,0,0]=4 2308 B14R1.3653 COc1ccc(cc1C)CNC(C)C 2230a_100102679029_100000210206 [0,0,1,0,0,1|2,0,0]=4 2309 B14R1.3653 COc1ccc(cc1C)CNC(C)C 2230a_100138425928_200011290836 [0,0,1,0,0,1|2,0,0]=4 2310 B14R1.3653 COc1ccc(cc1C)CNC(C)C 34a_100102679029_100000210206 [0,0,1,0,0,1|2,0,0]=4 2311 B14R1.3653 COc1ccc(cc1C)CNC(C)C 34a_100138425928_200011290836 [0,0,1,0,0,1|2,0,0]=4 2312 B14R1.3653 COc1ccc(cc1C)COC(C)C 34a_100000212225_200011290836 [0,0,1,0,0,1|2,0,0]=4 2313 B14R1.3653 COc1ccc(cc1C)COC(C)C 34a_200011290855_100000210206 [0,0,1,0,0,1|2,0,0]=4 2314 B14R1.3653 COc1ccc(cc1C)COC(C)C 7a_200011290855_100000210206 [0,0,1,0,0,1|2,0,0]=4 2315 B14R1.3653 COc1ccc(cc1C)CSC(C)C 62a_100000210206_200011290836 [0,0,1,0,0,1|2,0,0]=4 2316 B14R1.3653 COc1ccc(cc1C)CSC(C)C 62a_200011290836_100000210206 [0,0,1,0,0,1|2,0,0]=4 2317 B14R1.3653 COc1ccc(cc1C)NCC(C)C 2230a_100000743268_100000210760 [0,0,1,0,0,1|2,0,0]=4 2318 B14R1.3653 COc1ccc(cc1C)NCC(C)C 34a_100000743268_100000210624 [0,0,1,0,0,1|2,0,0]=4 2319 B14R1.3653 COc1ccc(cc1C)NCC(C)C 7a_100000743268_100000210760 [0,0,1,0,0,1|2,0,0]=4 2320 B14R1.3653 COc1ccc(cc1C)NCC(C)O 2230a_100000743268_100011218427 [0,0,1,0,0,1|2,0,0]=4 2321 B14R1.3653 COc1ccc(cc1C)NCC(C)O 34a_100000743268_100011218427 [0,0,1,0,0,1|2,0,0]=4 2322 B14R1.3653 COc1ccc(cc1C)NCC(C)O 7a_100000743268_100011218427 [0,0,1,0,0,1|2,0,0]=4 2323 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 2230a_100000743268_100009817552 [0,0,1,0,0,1|2,0,0]=4 2324 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 34a_100000743268_100009817552 [0,0,1,0,0,1|2,0,0]=4 2325 B14R1.3653 COc1ccc(cc1C)NC[C@@H](C)O 7a_100000743268_100009817552 [0,0,1,0,0,1|2,0,0]=4 2326 B14R1.3653 COc1ccc(cc1C)OCC(C)C 34a_100000759738_100000210624 [0,0,1,0,0,1|2,0,0]=4 2327 B14R1.3653 COc1ccc(cc1C)OCC(C)C 7a_100000759738_100000210760 [0,0,1,0,0,1|2,0,0]=4 2328 B14R1.3653 COc1ccc(cc1C)OCC(C)O 34a_100000759738_100011218427 [0,0,1,0,0,1|2,0,0]=4 2329 B14R1.3653 COc1ccc(cc1C)OCC(C)O 7a_100000759738_100011218427 [0,0,1,0,0,1|2,0,0]=4 2330 B14R1.3653 COc1ccc(cc1C)OC[C@@H](C)O 34a_100000759738_100009817552 [0,0,1,0,0,1|2,0,0]=4 2331 B14R1.3653 COc1ccc(cc1C)OC[C@@H](C)O 7a_100000759738_100009817552 [0,0,1,0,0,1|2,0,0]=4 2332 B14R1.3653 COc1ccc(cc1C)SCC(C)C 62a_100000210624_100011219705 [0,0,1,0,0,1|2,0,0]=4 2333 B14R1.3653 COc1ccc(cc1C)SCC(C)C 62a_100011219705_100000210760 [0,0,1,0,0,1|2,0,0]=4 2334 B14R1.3653 COc1ccc(cc1C)SCC(C)O 62a_100011218427_100011219705 [0,0,1,0,0,1|2,0,0]=4 2335 B14R1.3653 COc1ccc(cc1C)SCC(C)O 62a_100011219705_100011218427 [0,0,1,0,0,1|2,0,0]=4 2336 B14R1.3653 COc1ccc(cc1C)SC[C@@H](C)O 62a_100009817552_100011219705 [0,0,1,0,0,1|2,0,0]=4 2337 B14R1.3653 COc1ccc(cc1C)SC[C@@H](C)O 62a_100011219705_100009817552 [0,0,1,0,0,1|2,0,0]=4 2338 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 207a_100138425928_100000186747 [0,0,1,0,0,1|2,0,0]=4 2339 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 2230a_100000008799_100000210206 [0,0,1,0,0,1|2,0,0]=4 2340 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 2230a_100138425928_100000693707 [0,0,1,0,0,1|2,0,0]=4 2341 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 34a_100000008799_100000210206 [0,0,1,0,0,1|2,0,0]=4 2342 B14R1.3653 COc1ccc(cc1Cl)CNC(C)C 34a_100138425928_100000693707 [0,0,1,0,0,1|2,0,0]=4 2343 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 34a_100000212225_100000693707 [0,0,1,0,0,1|2,0,0]=4 2344 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 34a_100000694469_100000210206 [0,0,1,0,0,1|2,0,0]=4 2345 B14R1.3653 COc1ccc(cc1Cl)COC(C)C 7a_100000694469_100000210206 [0,0,1,0,0,1|2,0,0]=4 2346 B14R1.3653 COc1ccc(cc1Cl)CSC(C)C 62a_100000210206_100000693707 [0,0,1,0,0,1|2,0,0]=4 2347 B14R1.3653 COc1ccc(cc1Cl)CSC(C)C 62a_100000693707_100000210206 [0,0,1,0,0,1|2,0,0]=4 2348 B14R1.3653 COc1ccc(cc1Cl)NCC(C)C 2230a_100000211044_100000210760 [0,0,1,0,0,1|2,0,0]=4 2349 B14R1.3653 COc1ccc(cc1Cl)NCC(C)C 34a_100000211044_100000210624 [0,0,1,0,0,1|2,0,0]=4 2350 B14R1.3653 COc1ccc(cc1Cl)NCC(C)O 2230a_100000211044_100011218427 [0,0,1,0,0,1|2,0,0]=4 2351 B14R1.3653 COc1ccc(cc1Cl)NCC(C)O 34a_100000211044_100011218427 [0,0,1,0,0,1|2,0,0]=4 2352 B14R1.3653 COc1ccc(cc1Cl)NC[C@@H](C)O 2230a_100000211044_100009817552 [0,0,1,0,0,1|2,0,0]=4 2353 B14R1.3653 COc1ccc(cc1Cl)NC[C@@H](C)O 34a_100000211044_100009817552 [0,0,1,0,0,1|2,0,0]=4 2354 B14R1.3653 COc1ccc(cc1Cl)OCC(C)C 34a_200009861682_100000210624 [0,0,1,0,0,1|2,0,0]=4 2355 B14R1.3653 COc1ccc(cc1Cl)OCC(C)C 7a_200009861682_100000210760 [0,0,1,0,0,1|2,0,0]=4 2356 B14R1.3653 COc1ccc(cc1Cl)OCC(C)O 34a_200009861682_100011218427 [0,0,1,0,0,1|2,0,0]=4 2357 B14R1.3653 COc1ccc(cc1Cl)OCC(C)O 7a_200009861682_100011218427 [0,0,1,0,0,1|2,0,0]=4 2358 B14R1.3653 COc1ccc(cc1Cl)OC[C@@H](C)O 34a_200009861682_100009817552 [0,0,1,0,0,1|2,0,0]=4 2359 B14R1.3653 COc1ccc(cc1Cl)OC[C@@H](C)O 7a_200009861682_100009817552 [0,0,1,0,0,1|2,0,0]=4 2360 B14R1.3653 COc1ccc(cc1Cl)SCC(C)C 62a_100000210624_100012355395 [0,0,1,0,0,1|2,0,0]=4 2361 B14R1.3653 COc1ccc(cc1Cl)SCC(C)C 62a_100012355395_100000210760 [0,0,1,0,0,1|2,0,0]=4 2362 B14R1.3653 COc1ccc(cc1Cl)SCC(C)O 62a_100011218427_100012355395 [0,0,1,0,0,1|2,0,0]=4 2363 B14R1.3653 COc1ccc(cc1Cl)SCC(C)O 62a_100012355395_100011218427 [0,0,1,0,0,1|2,0,0]=4 2364 B14R1.3653 COc1ccc(cc1Cl)SC[C@@H](C)O 62a_100009817552_100012355395 [0,0,1,0,0,1|2,0,0]=4 2365 B14R1.3653 COc1ccc(cc1Cl)SC[C@@H](C)O 62a_100012355395_100009817552 [0,0,1,0,0,1|2,0,0]=4 2366 B14R1.3653 COc1ccc(cc1F)CNC(C)C 207a_100138425928_100000204617 [0,0,1,0,0,1|2,0,0]=4 2367 B14R1.3653 COc1ccc(cc1F)CNC(C)C 2230a_100000737316_100000210206 [0,0,1,0,0,1|2,0,0]=4 2368 B14R1.3653 COc1ccc(cc1F)CNC(C)C 2230a_100138425928_100000189595 [0,0,1,0,0,1|2,0,0]=4 2369 B14R1.3653 COc1ccc(cc1F)CNC(C)C 34a_100000737316_100000210206 [0,0,1,0,0,1|2,0,0]=4 2370 B14R1.3653 COc1ccc(cc1F)CNC(C)C 34a_100138425928_100000189595 [0,0,1,0,0,1|2,0,0]=4 2371 B14R1.3653 COc1ccc(cc1F)COC(C)C 34a_100000212225_100000189595 [0,0,1,0,0,1|2,0,0]=4 2372 B14R1.3653 COc1ccc(cc1F)COC(C)C 34a_100000246395_100000210206 [0,0,1,0,0,1|2,0,0]=4 2373 B14R1.3653 COc1ccc(cc1F)COC(C)C 7a_100000246395_100000210206 [0,0,1,0,0,1|2,0,0]=4 2374 B14R1.3653 COc1ccc(cc1F)CSC(C)C 62a_100000189595_100000210206 [0,0,1,0,0,1|2,0,0]=4 2375 B14R1.3653 COc1ccc(cc1F)CSC(C)C 62a_100000210206_100000189595 [0,0,1,0,0,1|2,0,0]=4 2376 B14R1.3653 COc1ccc(cc1F)NCC(C)C 2230a_100000740183_100000210760 [0,0,1,0,0,1|2,0,0]=4 2377 B14R1.3653 COc1ccc(cc1F)NCC(C)C 34a_100000740183_100000210624 [0,0,1,0,0,1|2,0,0]=4 2378 B14R1.3653 COc1ccc(cc1F)NCC(C)O 2230a_100000740183_100011218427 [0,0,1,0,0,1|2,0,0]=4 2379 B14R1.3653 COc1ccc(cc1F)NCC(C)O 34a_100000740183_100011218427 [0,0,1,0,0,1|2,0,0]=4 2380 B14R1.3653 COc1ccc(cc1F)NC[C@@H](C)O 2230a_100000740183_100009817552 [0,0,1,0,0,1|2,0,0]=4 2381 B14R1.3653 COc1ccc(cc1F)NC[C@@H](C)O 34a_100000740183_100009817552 [0,0,1,0,0,1|2,0,0]=4 2382 B14R1.3653 COc1ccc(cc1F)OCC(C)C 34a_100000746305_100000210624 [0,0,1,0,0,1|2,0,0]=4 2383 B14R1.3653 COc1ccc(cc1F)OCC(C)C 7a_100000746305_100000210760 [0,0,1,0,0,1|2,0,0]=4 2384 B14R1.3653 COc1ccc(cc1F)OCC(C)O 34a_100000746305_100011218427 [0,0,1,0,0,1|2,0,0]=4 2385 B14R1.3653 COc1ccc(cc1F)OCC(C)O 7a_100000746305_100011218427 [0,0,1,0,0,1|2,0,0]=4 2386 B14R1.3653 COc1ccc(cc1F)OC[C@@H](C)O 34a_100000746305_100009817552 [0,0,1,0,0,1|2,0,0]=4 2387 B14R1.3653 COc1ccc(cc1F)OC[C@@H](C)O 7a_100000746305_100009817552 [0,0,1,0,0,1|2,0,0]=4 2388 B14R1.3653 COc1ccc(cc1F)SCC(C)C 62a_100000171752_100000210760 [0,0,1,0,0,1|2,0,0]=4 2389 B14R1.3653 COc1ccc(cc1F)SCC(C)C 62a_100000210624_100000171752 [0,0,1,0,0,1|2,0,0]=4 2390 B14R1.3653 COc1ccc(cc1F)SCC(C)O 62a_100000171752_100011218427 [0,0,1,0,0,1|2,0,0]=4 2391 B14R1.3653 COc1ccc(cc1F)SCC(C)O 62a_100011218427_100000171752 [0,0,1,0,0,1|2,0,0]=4 2392 B14R1.3653 COc1ccc(cc1F)SC[C@@H](C)O 62a_100000171752_100009817552 [0,0,1,0,0,1|2,0,0]=4 2393 B14R1.3653 COc1ccc(cc1F)SC[C@@H](C)O 62a_100009817552_100000171752 [0,0,1,0,0,1|2,0,0]=4 2394 B14R1.3653 COc1ccc(cc1I)CNC(C)C 207a_100138425928_100009827998 [0,0,1,0,0,1|2,0,0]=4 2395 B14R1.3653 COc1ccc(cc1I)COC(C)C 34a_200000013966_100000210206 [0,0,1,0,0,1|2,0,0]=4 2396 B14R1.3653 COc1ccc(cc1I)COC(C)C 7a_200000013966_100000210206 [0,0,1,0,0,1|2,0,0]=4 2397 B14R1.3653 COc1ccc(cc1I)NCC(C)C 34a_100011356947_100000210624 [0,0,1,0,0,1|2,0,0]=4 2398 B14R1.3653 COc1ccc(cc1I)NCC(C)O 34a_100011356947_100011218427 [0,0,1,0,0,1|2,0,0]=4 2399 B14R1.3653 COc1ccc(cc1I)NC[C@@H](C)O 34a_100011356947_100009817552 [0,0,1,0,0,1|2,0,0]=4 2400 B14R1.3653 COc1ccc(cc1I)OCC(C)C 34a_100010084122_100000210624 [0,0,1,0,0,1|2,0,0]=4 2401 B14R1.3653 COc1ccc(cc1I)OCC(C)C 7a_100010084122_100000210760 [0,0,1,0,0,1|2,0,0]=4 2402 B14R1.3653 COc1ccc(cc1I)OCC(C)O 34a_100010084122_100011218427 [0,0,1,0,0,1|2,0,0]=4 2403 B14R1.3653 COc1ccc(cc1I)OCC(C)O 7a_100010084122_100011218427 [0,0,1,0,0,1|2,0,0]=4 2404 B14R1.3653 COc1ccc(cc1I)OC[C@@H](C)O 34a_100010084122_100009817552 [0,0,1,0,0,1|2,0,0]=4 2405 B14R1.3653 COc1ccc(cc1I)OC[C@@H](C)O 7a_100010084122_100009817552 [0,0,1,0,0,1|2,0,0]=4 2406 B14R1.3653 COc1ccc(cc1N)COC(C)C 34a_100011269841_100000210206 [0,0,1,0,0,1|2,0,0]=4 2407 B14R1.3653 COc1ccc(cc1N)SCC(C)C 62a_100000210624_100011249504 [0,0,1,0,0,1|2,0,0]=4 2408 B14R1.3653 COc1ccc(cc1N)SCC(C)C 62a_100011249504_100000210760 [0,0,1,0,0,1|2,0,0]=4 2409 B14R1.3653 COc1ccc(cc1N)SCC(C)O 62a_100011218427_100011249504 [0,0,1,0,0,1|2,0,0]=4 2410 B14R1.3653 COc1ccc(cc1N)SCC(C)O 62a_100011249504_100011218427 [0,0,1,0,0,1|2,0,0]=4 2411 B14R1.3653 COc1ccc(cc1N)SC[C@@H](C)O 62a_100009817552_100011249504 [0,0,1,0,0,1|2,0,0]=4 2412 B14R1.3653 COc1ccc(cc1N)SC[C@@H](C)O 62a_100011249504_100009817552 [0,0,1,0,0,1|2,0,0]=4 2413 B14R1.3653 COc1ccc(cc1O)C=CC(C)C 271570a_100016257149_100009816560 [0,0,1,0,0,1|1,0,1]=4 2414 B14R1.3653 COc1ccc(cc1O)C=CC(C)O 271570a_200011019289_100009816560 [0,0,1,0,0,1|1,0,1]=4 2415 B14R1.3653 COc1ccc(cc1O)CCC(=O)C 1458a_100000746301_200000210301 [0,0,1,0,0,1|1,0,1]=4 2416 B14R1.3653 COc1ccc(cc1O)CCC(=O)[13CH3] 1458a_100000746301_200025704644 [0,0,1,0,0,1|1,0,1]=4 2417 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 240690a_100000740000_100015343762 [0,0,1,0,0,1|1,0,1]=4 2418 B14R1.3653 COc1ccc(cc1O)CNC(=O)C 527a_100000740000_100103153847 [0,0,1,0,0,1|1,0,1]=4 2419 B14R1.3653 COc1ccc(cc1O)CNC(C)C 34a_100000740000_100000210206 [0,0,1,0,0,1|1,0,0]=3 2420 B14R1.3653 COc1ccc(cc1O)NCC(=O)N 34a_100000211920_100000187820 [0,0,1,0,0,1|1,0,1]=4 2421 B14R1.3653 COc1ccc(cc1O)NCC(C)C 34a_100000211920_100000210624 [0,0,1,0,0,1|1,0,0]=3 2422 B14R1.3653 COc1ccc(cc1O)NCC(C)O 34a_100000211920_100011218427 [0,0,1,0,0,1|1,0,0]=3 2423 B14R1.3653 COc1ccc(cc1O)NCC(F)F 34a_100000211920_100011934356 [0,0,1,0,0,1|2,0,0]=4 2424 B14R1.3653 COc1ccc(cc1O)NC[C@@H](C)O 34a_100000211920_100009817552 [0,0,1,0,0,1|1,0,0]=3 2425 B14R1.3653 COc1ccc(cc1O)SCC(=O)N 62a_100000747473_100009816560 [0,0,1,0,0,1|1,0,1]=4 2426 B14R1.3653 COc1ccc(cc1O)SCC(C)C 62a_100000210624_100009816560 [0,0,1,0,0,1|1,0,0]=3 2427 B14R1.3653 COc1ccc(cc1O)SCC(C)O 62a_100011218427_100009816560 [0,0,1,0,0,1|1,0,0]=3 2428 B14R1.3653 COc1ccc(cc1O)SCC(F)F 62a_100011934356_100009816560 [0,0,1,0,0,1|2,0,0]=4 2429 B14R1.3653 COc1ccc(cc1O)SC[C@@H](C)O 62a_100009817552_100009816560 [0,0,1,0,0,1|1,0,0]=3 2430 B14R1.3653 COc1cnc(cc1O)SCC(C)C 62a_100000210624_100010264082 [0,0,1,0,0,1|2,0,0]=4 2431 B14R1.3653 COc1cnc(cc1O)SCC(C)O 62a_100011218427_100010264082 [0,0,1,0,0,1|2,0,0]=4 2432 B14R1.3653 COc1cnc(cc1O)SC[C@@H](C)O 62a_100009817552_100010264082 [0,0,1,0,0,1|2,0,0]=4 2433 B14R1.3653 COc1ncc(cc1O)SCC(C)C 62a_100000210624_100010135713 [0,0,1,0,0,1|2,0,0]=4 2434 B14R1.3653 COc1ncc(cc1O)SCC(C)O 62a_100011218427_100010135713 [0,0,1,0,0,1|2,0,0]=4 2435 B14R1.3653 COc1ncc(cc1O)SC[C@@H](C)O 62a_100009817552_100010135713 [0,0,1,0,0,1|2,0,0]=4 2436 B14R1.42 C=C(C)CNc1ccc(c(c1)OC)O 34a_100000726020_100000748629 [0,0,1,0,0,1|1,0,1]=4 2437 B14R1.42 C=C(C)CSc1ccc(c(c1)OC)O 62a_100000748629_100000694246 [0,0,1,0,0,1|1,0,1]=4 2438 B14R1.42 CCc1cc(ccc1O)SCC(C)C 62a_100000210624_100012338938 [0,0,1,0,0,1|2,0,0]=4 2439 B14R1.42 CCc1cc(ccc1O)SCC(C)O 62a_100011218427_100012338938 [0,0,1,0,0,1|2,0,0]=4 2440 B14R1.42 CCc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100012338938 [0,0,1,0,0,1|2,0,0]=4 2441 B14R1.42 COc1cc(ccc1Br)CNC(C)C 207a_100138425928_100010244714 [0,0,1,0,0,1|2,0,0]=4 2442 B14R1.42 COc1cc(ccc1Br)CNC(C)C 2230a_100138425928_100010110085 [0,0,1,0,0,1|2,0,0]=4 2443 B14R1.42 COc1cc(ccc1Br)CNC(C)C 34a_100138425928_100010110085 [0,0,1,0,0,1|2,0,0]=4 2444 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100000212225_100010110085 [0,0,1,0,0,1|2,0,0]=4 2445 B14R1.42 COc1cc(ccc1Br)COC(C)C 34a_100010234685_100000210206 [0,0,1,0,0,1|2,0,0]=4 2446 B14R1.42 COc1cc(ccc1Br)COC(C)C 7a_100010234685_100000210206 [0,0,1,0,0,1|2,0,0]=4 2447 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100000210206_100010110085 [0,0,1,0,0,1|2,0,0]=4 2448 B14R1.42 COc1cc(ccc1Br)CSC(C)C 62a_100010110085_100000210206 [0,0,1,0,0,1|2,0,0]=4 2449 B14R1.42 COc1cc(ccc1Br)NCC(C)C 2230a_100000765947_100000210760 [0,0,1,0,0,1|2,0,0]=4 2450 B14R1.42 COc1cc(ccc1Br)NCC(C)C 34a_100000765947_100000210624 [0,0,1,0,0,1|2,0,0]=4 2451 B14R1.42 COc1cc(ccc1Br)NCC(C)O 2230a_100000765947_100011218427 [0,0,1,0,0,1|2,0,0]=4 2452 B14R1.42 COc1cc(ccc1Br)NCC(C)O 34a_100000765947_100011218427 [0,0,1,0,0,1|2,0,0]=4 2453 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 2230a_100000765947_100009817552 [0,0,1,0,0,1|2,0,0]=4 2454 B14R1.42 COc1cc(ccc1Br)NC[C@@H](C)O 34a_100000765947_100009817552 [0,0,1,0,0,1|2,0,0]=4 2455 B14R1.42 COc1cc(ccc1Br)OCC(C)C 34a_100011827694_100000210624 [0,0,1,0,0,1|2,0,0]=4 2456 B14R1.42 COc1cc(ccc1Br)OCC(C)C 7a_100011827694_100000210760 [0,0,1,0,0,1|2,0,0]=4 2457 B14R1.42 COc1cc(ccc1Br)OCC(C)O 34a_100011827694_100011218427 [0,0,1,0,0,1|2,0,0]=4 2458 B14R1.42 COc1cc(ccc1Br)OCC(C)O 7a_100011827694_100011218427 [0,0,1,0,0,1|2,0,0]=4 2459 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 34a_100011827694_100009817552 [0,0,1,0,0,1|2,0,0]=4 2460 B14R1.42 COc1cc(ccc1Br)OC[C@@H](C)O 7a_100011827694_100009817552 [0,0,1,0,0,1|2,0,0]=4 2461 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100000210624_100012353699 [0,0,1,0,0,1|2,0,0]=4 2462 B14R1.42 COc1cc(ccc1Br)SCC(C)C 62a_100012353699_100000210760 [0,0,1,0,0,1|2,0,0]=4 2463 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100011218427_100012353699 [0,0,1,0,0,1|2,0,0]=4 2464 B14R1.42 COc1cc(ccc1Br)SCC(C)O 62a_100012353699_100011218427 [0,0,1,0,0,1|2,0,0]=4 2465 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100009817552_100012353699 [0,0,1,0,0,1|2,0,0]=4 2466 B14R1.42 COc1cc(ccc1Br)SC[C@@H](C)O 62a_100012353699_100009817552 [0,0,1,0,0,1|2,0,0]=4 2467 B14R1.42 COc1cc(ccc1C)CNC(C)C 207a_100138425928_100000719150 [0,0,1,0,0,1|2,0,0]=4 2468 B14R1.42 COc1cc(ccc1C)COC(C)C 34a_100000752651_100000210206 [0,0,1,0,0,1|2,0,0]=4 2469 B14R1.42 COc1cc(ccc1C)COC(C)C 7a_100000752651_100000210206 [0,0,1,0,0,1|2,0,0]=4 2470 B14R1.42 COc1cc(ccc1C)NCC(C)C 2230a_100011279678_100000210760 [0,0,1,0,0,1|2,0,0]=4 2471 B14R1.42 COc1cc(ccc1C)NCC(C)C 34a_100011279678_100000210624 [0,0,1,0,0,1|2,0,0]=4 2472 B14R1.42 COc1cc(ccc1C)NCC(C)O 2230a_100011279678_100011218427 [0,0,1,0,0,1|2,0,0]=4 2473 B14R1.42 COc1cc(ccc1C)NCC(C)O 34a_100011279678_100011218427 [0,0,1,0,0,1|2,0,0]=4 2474 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 2230a_100011279678_100009817552 [0,0,1,0,0,1|2,0,0]=4 2475 B14R1.42 COc1cc(ccc1C)NC[C@@H](C)O 34a_100011279678_100009817552 [0,0,1,0,0,1|2,0,0]=4 2476 B14R1.42 COc1cc(ccc1C)OCC(C)C 34a_100009865632_100000210624 [0,0,1,0,0,1|2,0,0]=4 2477 B14R1.42 COc1cc(ccc1C)OCC(C)C 7a_100009865632_100000210760 [0,0,1,0,0,1|2,0,0]=4 2478 B14R1.42 COc1cc(ccc1C)OCC(C)O 34a_100009865632_100011218427 [0,0,1,0,0,1|2,0,0]=4 2479 B14R1.42 COc1cc(ccc1C)OCC(C)O 7a_100009865632_100011218427 [0,0,1,0,0,1|2,0,0]=4 2480 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 34a_100009865632_100009817552 [0,0,1,0,0,1|2,0,0]=4 2481 B14R1.42 COc1cc(ccc1C)OC[C@@H](C)O 7a_100009865632_100009817552 [0,0,1,0,0,1|2,0,0]=4 2482 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100000210624_100011830276 [0,0,1,0,0,1|2,0,0]=4 2483 B14R1.42 COc1cc(ccc1C)SCC(C)C 62a_100011830276_100000210760 [0,0,1,0,0,1|2,0,0]=4 2484 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011218427_100011830276 [0,0,1,0,0,1|2,0,0]=4 2485 B14R1.42 COc1cc(ccc1C)SCC(C)O 62a_100011830276_100011218427 [0,0,1,0,0,1|2,0,0]=4 2486 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100009817552_100011830276 [0,0,1,0,0,1|2,0,0]=4 2487 B14R1.42 COc1cc(ccc1C)SC[C@@H](C)O 62a_100011830276_100009817552 [0,0,1,0,0,1|2,0,0]=4 2488 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 207a_100138425928_100011998524 [0,0,1,0,0,1|2,0,0]=4 2489 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100015204853_100000210206 [0,0,1,0,0,1|2,0,0]=4 2490 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 2230a_100138425928_200010214485 [0,0,1,0,0,1|2,0,0]=4 2491 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100015204853_100000210206 [0,0,1,0,0,1|2,0,0]=4 2492 B14R1.42 COc1cc(ccc1Cl)CNC(C)C 34a_100138425928_200010214485 [0,0,1,0,0,1|2,0,0]=4 2493 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100000212225_200010214485 [0,0,1,0,0,1|2,0,0]=4 2494 B14R1.42 COc1cc(ccc1Cl)COC(C)C 34a_100012179228_100000210206 [0,0,1,0,0,1|2,0,0]=4 2495 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_100000210206_200010214485 [0,0,1,0,0,1|2,0,0]=4 2496 B14R1.42 COc1cc(ccc1Cl)CSC(C)C 62a_200010214485_100000210206 [0,0,1,0,0,1|2,0,0]=4 2497 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 2230a_100000742311_100000210760 [0,0,1,0,0,1|2,0,0]=4 2498 B14R1.42 COc1cc(ccc1Cl)NCC(C)C 34a_100000742311_100000210624 [0,0,1,0,0,1|2,0,0]=4 2499 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 2230a_100000742311_100011218427 [0,0,1,0,0,1|2,0,0]=4 2500 B14R1.42 COc1cc(ccc1Cl)NCC(C)O 34a_100000742311_100011218427 [0,0,1,0,0,1|2,0,0]=4 2501 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 2230a_100000742311_100009817552 [0,0,1,0,0,1|2,0,0]=4 2502 B14R1.42 COc1cc(ccc1Cl)NC[C@@H](C)O 34a_100000742311_100009817552 [0,0,1,0,0,1|2,0,0]=4 2503 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 34a_100012186310_100000210624 [0,0,1,0,0,1|2,0,0]=4 2504 B14R1.42 COc1cc(ccc1Cl)OCC(C)C 7a_100012186310_100000210760 [0,0,1,0,0,1|2,0,0]=4 2505 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 34a_100012186310_100011218427 [0,0,1,0,0,1|2,0,0]=4 2506 B14R1.42 COc1cc(ccc1Cl)OCC(C)O 7a_100012186310_100011218427 [0,0,1,0,0,1|2,0,0]=4 2507 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 34a_100012186310_100009817552 [0,0,1,0,0,1|2,0,0]=4 2508 B14R1.42 COc1cc(ccc1Cl)OC[C@@H](C)O 7a_100012186310_100009817552 [0,0,1,0,0,1|2,0,0]=4 2509 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100000210624_100011356853 [0,0,1,0,0,1|2,0,0]=4 2510 B14R1.42 COc1cc(ccc1Cl)SCC(C)C 62a_100011356853_100000210760 [0,0,1,0,0,1|2,0,0]=4 2511 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011218427_100011356853 [0,0,1,0,0,1|2,0,0]=4 2512 B14R1.42 COc1cc(ccc1Cl)SCC(C)O 62a_100011356853_100011218427 [0,0,1,0,0,1|2,0,0]=4 2513 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100009817552_100011356853 [0,0,1,0,0,1|2,0,0]=4 2514 B14R1.42 COc1cc(ccc1Cl)SC[C@@H](C)O 62a_100011356853_100009817552 [0,0,1,0,0,1|2,0,0]=4 2515 B14R1.42 COc1cc(ccc1F)CNC(C)C 207a_100138425928_100000692873 [0,0,1,0,0,1|2,0,0]=4 2516 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100020626639_100000210206 [0,0,1,0,0,1|2,0,0]=4 2517 B14R1.42 COc1cc(ccc1F)CNC(C)C 2230a_100138425928_100012349856 [0,0,1,0,0,1|2,0,0]=4 2518 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100020626639_100000210206 [0,0,1,0,0,1|2,0,0]=4 2519 B14R1.42 COc1cc(ccc1F)CNC(C)C 34a_100138425928_100012349856 [0,0,1,0,0,1|2,0,0]=4 2520 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000212225_100012349856 [0,0,1,0,0,1|2,0,0]=4 2521 B14R1.42 COc1cc(ccc1F)COC(C)C 34a_100000692429_100000210206 [0,0,1,0,0,1|2,0,0]=4 2522 B14R1.42 COc1cc(ccc1F)COC(C)C 7a_100000692429_100000210206 [0,0,1,0,0,1|2,0,0]=4 2523 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100000210206_100012349856 [0,0,1,0,0,1|2,0,0]=4 2524 B14R1.42 COc1cc(ccc1F)CSC(C)C 62a_100012349856_100000210206 [0,0,1,0,0,1|2,0,0]=4 2525 B14R1.42 COc1cc(ccc1F)NCC(C)C 2230a_100000701188_100000210760 [0,0,1,0,0,1|2,0,0]=4 2526 B14R1.42 COc1cc(ccc1F)NCC(C)C 34a_100000701188_100000210624 [0,0,1,0,0,1|2,0,0]=4 2527 B14R1.42 COc1cc(ccc1F)NCC(C)O 2230a_100000701188_100011218427 [0,0,1,0,0,1|2,0,0]=4 2528 B14R1.42 COc1cc(ccc1F)NCC(C)O 34a_100000701188_100011218427 [0,0,1,0,0,1|2,0,0]=4 2529 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 2230a_100000701188_100009817552 [0,0,1,0,0,1|2,0,0]=4 2530 B14R1.42 COc1cc(ccc1F)NC[C@@H](C)O 34a_100000701188_100009817552 [0,0,1,0,0,1|2,0,0]=4 2531 B14R1.42 COc1cc(ccc1F)OCC(C)C 34a_100012001760_100000210624 [0,0,1,0,0,1|2,0,0]=4 2532 B14R1.42 COc1cc(ccc1F)OCC(C)C 7a_100012001760_100000210760 [0,0,1,0,0,1|2,0,0]=4 2533 B14R1.42 COc1cc(ccc1F)OCC(C)O 34a_100012001760_100011218427 [0,0,1,0,0,1|2,0,0]=4 2534 B14R1.42 COc1cc(ccc1F)OCC(C)O 7a_100012001760_100011218427 [0,0,1,0,0,1|2,0,0]=4 2535 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 34a_100012001760_100009817552 [0,0,1,0,0,1|2,0,0]=4 2536 B14R1.42 COc1cc(ccc1F)OC[C@@H](C)O 7a_100012001760_100009817552 [0,0,1,0,0,1|2,0,0]=4 2537 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100000210624_100011934186 [0,0,1,0,0,1|2,0,0]=4 2538 B14R1.42 COc1cc(ccc1F)SCC(C)C 62a_100011934186_100000210760 [0,0,1,0,0,1|2,0,0]=4 2539 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011218427_100011934186 [0,0,1,0,0,1|2,0,0]=4 2540 B14R1.42 COc1cc(ccc1F)SCC(C)O 62a_100011934186_100011218427 [0,0,1,0,0,1|2,0,0]=4 2541 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100009817552_100011934186 [0,0,1,0,0,1|2,0,0]=4 2542 B14R1.42 COc1cc(ccc1F)SC[C@@H](C)O 62a_100011934186_100009817552 [0,0,1,0,0,1|2,0,0]=4 2543 B14R1.42 COc1cc(ccc1I)NCC(C)C 34a_100000746945_100000210624 [0,0,1,0,0,1|2,0,0]=4 2544 B14R1.42 COc1cc(ccc1I)NCC(C)O 34a_100000746945_100011218427 [0,0,1,0,0,1|2,0,0]=4 2545 B14R1.42 COc1cc(ccc1I)NC[C@@H](C)O 34a_100000746945_100009817552 [0,0,1,0,0,1|2,0,0]=4 2546 B14R1.42 COc1cc(ccc1N)COC(C)C 34a_100000087641_100000210206 [0,0,1,0,0,1|2,0,0]=4 2547 B14R1.42 COc1cc(ccc1N)OCC(C)C 34a_100015326901_100000210624 [0,0,1,0,0,1|2,0,0]=4 2548 B14R1.42 COc1cc(ccc1N)OCC(C)C 7a_100015326901_100000210760 [0,0,1,0,0,1|2,0,0]=4 2549 B14R1.42 COc1cc(ccc1N)OCC(C)O 34a_100015326901_100011218427 [0,0,1,0,0,1|2,0,0]=4 2550 B14R1.42 COc1cc(ccc1N)OCC(C)O 7a_100015326901_100011218427 [0,0,1,0,0,1|2,0,0]=4 2551 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 34a_100015326901_100009817552 [0,0,1,0,0,1|2,0,0]=4 2552 B14R1.42 COc1cc(ccc1N)OC[C@@H](C)O 7a_100015326901_100009817552 [0,0,1,0,0,1|2,0,0]=4 2553 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100000210624_100015196925 [0,0,1,0,0,1|2,0,0]=4 2554 B14R1.42 COc1cc(ccc1N)SCC(C)C 62a_100011279103_100000210760 [0,0,1,0,0,1|2,0,0]=4 2555 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011218427_100015196925 [0,0,1,0,0,1|2,0,0]=4 2556 B14R1.42 COc1cc(ccc1N)SCC(C)O 62a_100011279103_100011218427 [0,0,1,0,0,1|2,0,0]=4 2557 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100009817552_100015196925 [0,0,1,0,0,1|2,0,0]=4 2558 B14R1.42 COc1cc(ccc1N)SC[C@@H](C)O 62a_100011279103_100009817552 [0,0,1,0,0,1|2,0,0]=4 2559 B14R1.42 COc1cc(ccc1O)C=CC(C)C 271570a_100016257149_100000694246 [0,0,1,0,0,1|1,0,1]=4 2560 B14R1.42 COc1cc(ccc1O)C=CC(C)O 271570a_200011019289_100000694246 [0,0,1,0,0,1|1,0,1]=4 2561 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100000070787_100010741665 [0,0,1,0,0,1|1,0,1]=4 2562 B14R1.42 COc1cc(ccc1O)CCC(=O)C 1458a_100011216321_200000210301 [0,0,1,0,0,1|1,0,1]=4 2563 B14R1.42 COc1cc(ccc1O)CCC(=O)[13CH3] 1458a_100011216321_200025704644 [0,0,1,0,0,1|1,0,1]=4 2564 B14R1.42 COc1cc(ccc1O)CCN(C)C 2230a_100102631434_100010741665 [0,0,1,0,0,1|2,0,0]=4 2565 B14R1.42 COc1cc(ccc1O)CCN(C)C 269982a_100102631434_100010741665 [0,0,1,0,0,1|2,0,0]=4 2566 B14R1.42 COc1cc(ccc1O)CNC(=O)C 11a_100000185554_100015343762 [0,0,1,0,0,1|1,0,1]=4 2567 B14R1.42 COc1cc(ccc1O)CNC(=O)C 240690a_100000185554_100015343762 [0,0,1,0,0,1|1,0,1]=4 2568 B14R1.42 COc1cc(ccc1O)CNC(=O)C 527a_100000185554_100103153847 [0,0,1,0,0,1|1,0,1]=4 2569 B14R1.42 COc1cc(ccc1O)CNC(C)C 34a_100000185554_100000210206 [0,0,1,0,0,1|1,0,0]=3 2570 B14R1.42 COc1cc(ccc1O)NCC(=O)N 34a_100000726020_100000187820 [0,0,1,0,0,1|1,0,1]=4 2571 B14R1.42 COc1cc(ccc1O)NCC(C)C 34a_100000726020_100000210624 [0,0,1,0,0,1|1,0,0]=3 2572 B14R1.42 COc1cc(ccc1O)NCC(C)O 34a_100000726020_100011218427 [0,0,1,0,0,1|1,0,0]=3 2573 B14R1.42 COc1cc(ccc1O)NCC(F)F 34a_100000726020_100011934356 [0,0,1,0,0,1|2,0,0]=4 2574 B14R1.42 COc1cc(ccc1O)NC[C@@H](C)O 34a_100000726020_100009817552 [0,0,1,0,0,1|1,0,0]=3 2575 B14R1.42 COc1cc(ccc1O)SCC(=O)N 62a_100000747473_100000694246 [0,0,1,0,0,1|1,0,1]=4 2576 B14R1.42 COc1cc(ccc1O)SCC(C)C 62a_100000210624_100000694246 [0,0,1,0,0,1|1,0,0]=3 2577 B14R1.42 COc1cc(ccc1O)SCC(C)O 62a_100011218427_100000694246 [0,0,1,0,0,1|1,0,0]=3 2578 B14R1.42 COc1cc(ccc1O)SCC(F)F 62a_100011934356_100000694246 [0,0,1,0,0,1|2,0,0]=4 2579 B14R1.42 COc1cc(ccc1O)SC[C@@H](C)O 62a_100009817552_100000694246 [0,0,1,0,0,1|1,0,0]=3 2580 B14R1.42 COc1nc(ccc1O)SCC(C)C 62a_100000210624_100010893133 [0,0,1,0,0,1|2,0,0]=4 2581 B14R1.42 COc1nc(ccc1O)SCC(C)O 62a_100011218427_100010893133 [0,0,1,0,0,1|2,0,0]=4 2582 B14R1.42 COc1nc(ccc1O)SC[C@@H](C)O 62a_100009817552_100010893133 [0,0,1,0,0,1|2,0,0]=4 2583 B14R1.142 CC(C)CNc1ccc(cc1)CCO 2230a_100011204434_100000210760 [0,0,1,0,0,1|2,0,0]=4 2584 B14R1.142 CC(C)CNc1ccc(cc1)CCO 34a_100011204434_100000210624 [0,0,1,0,0,1|2,0,0]=4 2585 B14R1.142 CC(C)COc1ccc(cc1)CCO 34a_100011215338_100000210624 [0,0,1,0,0,1|2,0,0]=4 2586 B14R1.142 CC(C)COc1ccc(cc1)CCO 7a_100011215338_100000210760 [0,0,1,0,0,1|2,0,0]=4 2587 B14R1.142 CC(C)CSc1ccc(cc1)CCO 62a_100000210624_100000766406 [0,0,1,0,0,1|2,0,0]=4 2588 B14R1.142 CC(C)CSc1ccc(cc1)CCO 62a_100000766406_100000210760 [0,0,1,0,0,1|2,0,0]=4 2589 B14R1.142 CC(O)CCc1ccc(cc1)OCF 34a_100000189425_100015361967 [0,0,1,0,0,1|2,0,0]=4 2590 B14R1.142 CC(O)CCc1ccc(cc1)OCF 7a_100000189425_100015361967 [0,0,1,0,0,1|2,0,0]=4 2591 B14R1.142 CC(O)CNc1ccc(cc1)CCO 2230a_100011204434_100011218427 [0,0,1,0,0,1|2,0,0]=4 2592 B14R1.142 CC(O)CNc1ccc(cc1)CCO 34a_100011204434_100011218427 [0,0,1,0,0,1|2,0,0]=4 2593 B14R1.142 CC(O)COc1ccc(cc1)CCO 34a_100011215338_100011218427 [0,0,1,0,0,1|2,0,0]=4 2594 B14R1.142 CC(O)COc1ccc(cc1)CCO 7a_100011215338_100011218427 [0,0,1,0,0,1|2,0,0]=4 2595 B14R1.142 CC(O)CSc1ccc(cc1)CCO 62a_100000766406_100011218427 [0,0,1,0,0,1|2,0,0]=4 2596 B14R1.142 CC(O)CSc1ccc(cc1)CCO 62a_100011218427_100000766406 [0,0,1,0,0,1|2,0,0]=4 2597 B14R1.142 CCOc1ccc(cc1)CCC(C)O 34a_100000189425_100000210202 [0,0,1,0,0,1|2,0,0]=4 2598 B14R1.142 CCOc1ccc(cc1)CCC(C)O 7a_100000189425_100000210202 [0,0,1,0,0,1|2,0,0]=4 2599 B14R1.142 CCOc1ccc(cc1)CNC(C)C 207a_100138425928_100000169836 [0,0,1,0,0,1|2,0,0]=4 2600 B14R1.142 CCOc1ccc(cc1)CNC(C)C 2230a_100000185588_100000210206 [0,0,1,0,0,1|2,0,0]=4 2601 B14R1.142 CCOc1ccc(cc1)CNC(C)C 34a_100000185588_100000210206 [0,0,1,0,0,1|2,0,0]=4 2602 B14R1.142 CCOc1ccc(cc1)COC(C)C 34a_100000173027_100000210206 [0,0,1,0,0,1|2,0,0]=4 2603 B14R1.142 CCOc1ccc(cc1)COC(C)C 7a_100000173027_100000210206 [0,0,1,0,0,1|2,0,0]=4 2604 B14R1.142 CCOc1ccc(cc1)NCC(C)C 2230a_100000739623_100000210760 [0,0,1,0,0,1|2,0,0]=4 2605 B14R1.142 CCOc1ccc(cc1)NCC(C)C 34a_100000739623_100000210624 [0,0,1,0,0,1|2,0,0]=4 2606 B14R1.142 CCOc1ccc(cc1)NCC(C)O 2230a_100000739623_100011218427 [0,0,1,0,0,1|2,0,0]=4 2607 B14R1.142 CCOc1ccc(cc1)NCC(C)O 34a_100000739623_100011218427 [0,0,1,0,0,1|2,0,0]=4 2608 B14R1.142 CCOc1ccc(cc1)NC[C@@H](C)O 2230a_100000739623_100009817552 [0,0,1,0,0,1|2,0,0]=4 2609 B14R1.142 CCOc1ccc(cc1)NC[C@@H](C)O 34a_100000739623_100009817552 [0,0,1,0,0,1|2,0,0]=4 2610 B14R1.142 CCOc1ccc(cc1)OCC(C)C 34a_100000185467_100000210624 [0,0,1,0,0,1|2,0,0]=4 2611 B14R1.142 CCOc1ccc(cc1)OCC(C)O 34a_100000185467_100011218427 [0,0,1,0,0,1|2,0,0]=4 2612 B14R1.142 CCOc1ccc(cc1)OC[C@@H](C)O 34a_100000185467_100009817552 [0,0,1,0,0,1|2,0,0]=4 2613 B14R1.142 CCOc1ccc(cc1)SCC(C)C 62a_100000210624_100000171712 [0,0,1,0,0,1|2,0,0]=4 2614 B14R1.142 CCOc1ccc(cc1)SCC(C)O 62a_100011218427_100000171712 [0,0,1,0,0,1|2,0,0]=4 2615 B14R1.142 CCOc1ccc(cc1)SC[C@@H](C)O 62a_100009817552_100000171712 [0,0,1,0,0,1|2,0,0]=4 2616 B14R1.142 C[C@@H](O)CNc1ccc(cc1)CCO 2230a_100011204434_100009817552 [0,0,1,0,0,1|2,0,0]=4 2617 B14R1.142 C[C@@H](O)CNc1ccc(cc1)CCO 34a_100011204434_100009817552 [0,0,1,0,0,1|2,0,0]=4 2618 B14R1.142 C[C@@H](O)COc1ccc(cc1)CCO 34a_100011215338_100009817552 [0,0,1,0,0,1|2,0,0]=4 2619 B14R1.142 C[C@@H](O)COc1ccc(cc1)CCO 7a_100011215338_100009817552 [0,0,1,0,0,1|2,0,0]=4 2620 B14R1.142 C[C@@H](O)CSc1ccc(cc1)CCO 62a_100000766406_100009817552 [0,0,1,0,0,1|2,0,0]=4 2621 B14R1.142 C[C@@H](O)CSc1ccc(cc1)CCO 62a_100009817552_100000766406 [0,0,1,0,0,1|2,0,0]=4 2622 B14R1.468 CC(C)CNc1cccc(c1)CCO 2230a_100011996697_100000210760 [0,0,1,0,0,1|2,0,0]=4 2623 B14R1.468 CC(C)CNc1cccc(c1)CCO 34a_100011996697_100000210624 [0,0,1,0,0,1|2,0,0]=4 2624 B14R1.468 CC(C)COc1cccc(c1)CCO 34a_100011215281_100000210624 [0,0,1,0,0,1|2,0,0]=4 2625 B14R1.468 CC(C)COc1cccc(c1)CCO 7a_100011215281_100000210760 [0,0,1,0,0,1|2,0,0]=4 2626 B14R1.468 CC(C)CSc1cccc(c1)CCO 62a_100000210624_100011217444 [0,0,1,0,0,1|2,0,0]=4 2627 B14R1.468 CC(C)CSc1cccc(c1)CCO 62a_100011217444_100000210760 [0,0,1,0,0,1|2,0,0]=4 2628 B14R1.468 CC(O)CNc1cccc(c1)CCO 2230a_100011996697_100011218427 [0,0,1,0,0,1|2,0,0]=4 2629 B14R1.468 CC(O)CNc1cccc(c1)CCO 34a_100011996697_100011218427 [0,0,1,0,0,1|2,0,0]=4 2630 B14R1.468 CC(O)COc1cccc(c1)CCO 34a_100011215281_100011218427 [0,0,1,0,0,1|2,0,0]=4 2631 B14R1.468 CC(O)COc1cccc(c1)CCO 7a_100011215281_100011218427 [0,0,1,0,0,1|2,0,0]=4 2632 B14R1.468 CC(O)CSc1cccc(c1)CCO 62a_100011217444_100011218427 [0,0,1,0,0,1|2,0,0]=4 2633 B14R1.468 CC(O)CSc1cccc(c1)CCO 62a_100011218427_100011217444 [0,0,1,0,0,1|2,0,0]=4 2634 B14R1.468 CCOc1cccc(c1)CNC(C)C 207a_100138425928_100000170239 [0,0,1,0,0,1|2,0,0]=4 2635 B14R1.468 CCOc1cccc(c1)CNC(C)C 2230a_106359896916_100000210206 [0,0,1,0,0,1|2,0,0]=4 2636 B14R1.468 CCOc1cccc(c1)CNC(C)C 34a_106359896916_100000210206 [0,0,1,0,0,1|2,0,0]=4 2637 B14R1.468 CCOc1cccc(c1)COC(C)C 34a_200011232711_100000210206 [0,0,1,0,0,1|2,0,0]=4 2638 B14R1.468 CCOc1cccc(c1)COC(C)C 7a_200011232711_100000210206 [0,0,1,0,0,1|2,0,0]=4 2639 B14R1.468 CCOc1cccc(c1)NCC(C)C 2230a_100000742568_100000210760 [0,0,1,0,0,1|2,0,0]=4 2640 B14R1.468 CCOc1cccc(c1)NCC(C)C 34a_100000742568_100000210624 [0,0,1,0,0,1|2,0,0]=4 2641 B14R1.468 CCOc1cccc(c1)NCC(C)O 2230a_100000742568_100011218427 [0,0,1,0,0,1|2,0,0]=4 2642 B14R1.468 CCOc1cccc(c1)NCC(C)O 34a_100000742568_100011218427 [0,0,1,0,0,1|2,0,0]=4 2643 B14R1.468 CCOc1cccc(c1)NC[C@@H](C)O 2230a_100000742568_100009817552 [0,0,1,0,0,1|2,0,0]=4 2644 B14R1.468 CCOc1cccc(c1)NC[C@@H](C)O 34a_100000742568_100009817552 [0,0,1,0,0,1|2,0,0]=4 2645 B14R1.468 CCOc1cccc(c1)OCC(C)C 34a_100011215941_100000210624 [0,0,1,0,0,1|2,0,0]=4 2646 B14R1.468 CCOc1cccc(c1)OCC(C)C 7a_100011215941_100000210760 [0,0,1,0,0,1|2,0,0]=4 2647 B14R1.468 CCOc1cccc(c1)OCC(C)O 34a_100011215941_100011218427 [0,0,1,0,0,1|2,0,0]=4 2648 B14R1.468 CCOc1cccc(c1)OCC(C)O 7a_100011215941_100011218427 [0,0,1,0,0,1|2,0,0]=4 2649 B14R1.468 CCOc1cccc(c1)OC[C@@H](C)O 34a_100011215941_100009817552 [0,0,1,0,0,1|2,0,0]=4 2650 B14R1.468 CCOc1cccc(c1)OC[C@@H](C)O 7a_100011215941_100009817552 [0,0,1,0,0,1|2,0,0]=4 2651 B14R1.468 CCOc1cccc(c1)SCC(C)C 62a_100000210624_100000170002 [0,0,1,0,0,1|2,0,0]=4 2652 B14R1.468 CCOc1cccc(c1)SCC(C)O 62a_100011218427_100000170002 [0,0,1,0,0,1|2,0,0]=4 2653 B14R1.468 CCOc1cccc(c1)SC[C@@H](C)O 62a_100009817552_100000170002 [0,0,1,0,0,1|2,0,0]=4 2654 B14R1.468 C[C@@H](O)CNc1cccc(c1)CCO 2230a_100011996697_100009817552 [0,0,1,0,0,1|2,0,0]=4 2655 B14R1.468 C[C@@H](O)CNc1cccc(c1)CCO 34a_100011996697_100009817552 [0,0,1,0,0,1|2,0,0]=4 2656 B14R1.468 C[C@@H](O)COc1cccc(c1)CCO 34a_100011215281_100009817552 [0,0,1,0,0,1|2,0,0]=4 2657 B14R1.468 C[C@@H](O)COc1cccc(c1)CCO 7a_100011215281_100009817552 [0,0,1,0,0,1|2,0,0]=4 2658 B14R1.468 C[C@@H](O)CSc1cccc(c1)CCO 62a_100009817552_100011217444 [0,0,1,0,0,1|2,0,0]=4 2659 B14R1.468 C[C@@H](O)CSc1cccc(c1)CCO 62a_100011217444_100009817552 [0,0,1,0,0,1|2,0,0]=4 2660 B14R2.112 CC=Cc1ccc2c(c1)OCCO2 271570a_100016259895_100000184379 [1,0,0,0,0,1|0,0,2]=4 2661 B14R2.112 CCNc1ccc2c(c1)CCCO2 2230a_100138412508_100000210202 [1,0,0,0,0,1|2,0,0]=4 2662 B14R2.112 CCNc1ccc2c(c1)CCCO2 34a_100138412508_100000210202 [1,0,0,0,0,1|2,0,0]=4 2663 B14R2.112 CCNc1ccc2c(c1)OCCO2 2230a_100020630400_100000210202 [1,0,0,0,0,1|1,0,0]=3 2664 B14R2.112 CCNc1ccc2c(c1)OCCO2 34a_100020630400_100000210202 [1,0,0,0,0,1|1,0,0]=3 2665 B14R2.112 CCOc1ccc2c(c1)CCOC2 34a_100009841951_100000210202 [1,0,0,0,0,1|2,0,0]=4 2666 B14R2.112 CCOc1ccc2c(c1)CCOC2 7a_100009841951_100000210202 [1,0,0,0,0,1|2,0,0]=4 2667 B14R2.112 CCOc1ccc2c(c1)NCCO2 34a_100020636358_100000210202 [1,0,0,0,0,1|2,0,0]=4 2668 B14R2.112 CCOc1ccc2c(c1)OCCO2 34a_100000234341_100000210202 [1,0,0,0,0,1|1,0,0]=3 2669 B14R2.112 CCSc1ccc2c(c1)CCCO2 62a_100000210202_100011393166 [1,0,0,0,0,1|2,0,0]=4 2670 B14R2.112 CCSc1ccc2c(c1)CCCO2 62a_100011393166_100000210202 [1,0,0,0,0,1|2,0,0]=4 2671 B14R2.112 CCSc1ccc2c(c1)COCC2 62a_100000210202_100010128096 [1,0,0,0,0,1|2,0,0]=4 2672 B14R2.112 CCSc1ccc2c(c1)COCC2 62a_100010128096_100000210202 [1,0,0,0,0,1|2,0,0]=4 2673 B14R2.112 CCSc1ccc2c(c1)NCCO2 62a_100000210202_100000708519 [1,0,0,0,0,1|2,0,0]=4 2674 B14R2.112 CCSc1ccc2c(c1)OCCC2 62a_100000210202_100010700467 [1,0,0,0,0,1|2,0,0]=4 2675 B14R2.112 CCSc1ccc2c(c1)OCCC2 62a_100010700467_100000210202 [1,0,0,0,0,1|2,0,0]=4 2676 B14R2.112 CCSc1ccc2c(c1)OCCN2 62a_100000210202_100012355470 [1,0,0,0,0,1|2,0,0]=4 2677 B14R2.112 CCSc1ccc2c(c1)OCCO2 62a_100000210202_100011216881 [1,0,0,0,0,1|1,0,0]=3 2678 B14R2.112 CCSc1ccc2c(c1)OCCO2 62a_100011216881_100000210202 [1,0,0,0,0,1|1,0,0]=3 2679 B14R2.112 CNCc1ccc2c(c1)CCCO2 207a_100102657272_100011934692 [1,0,0,0,0,1|2,0,0]=4 2680 B14R2.112 CNCc1ccc2c(c1)CCCO2 270004a_106832991635_100011934692 [1,0,0,0,0,1|2,0,0]=4 2681 B14R2.112 CNCc1ccc2c(c1)CCOC2 26a_100102657272_100009841951 [1,0,0,0,0,1|2,0,0]=4 2682 B14R2.112 CNCc1ccc2c(c1)OCCO2 207a_100102657272_100000184955 [1,0,0,0,0,1|1,0,0]=3 2683 B14R2.112 CNCc1ccc2c(c1)OCCO2 2230a_100000684186_200000210301 [1,0,0,0,0,1|1,0,0]=3 2684 B14R2.112 CNCc1ccc2c(c1)OCCO2 270004a_106832991635_100000184955 [1,0,0,0,0,1|1,0,0]=3 2685 B14R2.112 CNCc1ccc2c(c1)OCCO2 34a_100000684186_200000210301 [1,0,0,0,0,1|1,0,0]=3 2686 B14R2.112 CNCc1ccc2c(n1)OCCO2 207a_100102657272_100009856165 [1,0,0,0,0,1|2,0,0]=4 2687 B14R2.112 CNCc1ccc2c(n1)OCCO2 270004a_106832991635_100009856165 [1,0,0,0,0,1|2,0,0]=4 2688 B14R2.112 COCc1ccc2c(c1)OCCO2 34a_100000745213_200000210301 [1,0,0,0,0,1|1,0,0]=3 2689 B14R2.112 FCNc1ccc2c(c1)OCCO2 34a_100020630400_100015361967 [1,0,0,0,0,1|2,0,0]=4 2690 B14R2.112 FCOc1ccc2c(c1)OCCO2 34a_100000234341_100015361967 [1,0,0,0,0,1|2,0,0]=4 2691 B14R2.112 FCSc1ccc2c(c1)OCCO2 62a_100011216881_100015361967 [1,0,0,0,0,1|2,0,0]=4 2692 B14R2.112 FCSc1ccc2c(c1)OCCO2 62a_100015361967_100011216881 [1,0,0,0,0,1|2,0,0]=4 2693 B14R2.112 [13CH3]NCc1ccc2c(c1)OCCO2 2230a_100000684186_200025704644 [1,0,0,0,0,1|1,0,0]=3 2694 B14R2.112 [13CH3]NCc1ccc2c(c1)OCCO2 34a_100000684186_200025704644 [1,0,0,0,0,1|1,0,0]=3 2695 B14R2.112 [13CH3]OCc1ccc2c(c1)OCCO2 34a_100000745213_200025704644 [1,0,0,0,0,1|1,0,0]=3 2696 B14R2.781 C=C(C)c1ccc2c(c1)OCCO2 271570a_100000694244_100000184379 [0,0,0,0,1,1|1,0,1]=4 2697 B14R2.781 CC(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200000210301 [0,0,0,0,1,1|1,0,1]=4 2698 B14R2.781 [13CH3]C(=O)c1ccc2c(c1)OCCO2 1458a_100000182659_200025704644 [0,0,0,0,1,1|1,0,1]=4 2699 B14R2.1264 CC(C)CSc1ccc2c(c1)CC2 62a_100000210624_100009818592 [0,0,0,0,1,1|2,0,0]=4 2700 B14R2.1264 CC(C)CSc1ccc2c(c1)CC2 62a_100009818592_100000210760 [0,0,0,0,1,1|2,0,0]=4 2701 B14R2.1264 CC(C)NCc1ccc2c(c1)CC2 207a_100138425928_100010273998 [0,0,0,0,1,1|2,0,0]=4 2702 B14R2.1264 CC(C)OCc1ccc2c(c1)CC2 34a_100010733339_100000210206 [0,0,0,0,1,1|2,0,0]=4 2703 B14R2.1264 CC(C)OCc1ccc2c(c1)CC2 7a_100010733339_100000210206 [0,0,0,0,1,1|2,0,0]=4 2704 B14R2.1264 CC(O)CSc1ccc2c(c1)CC2 62a_100009818592_100011218427 [0,0,0,0,1,1|2,0,0]=4 2705 B14R2.1264 CC(O)CSc1ccc2c(c1)CC2 62a_100011218427_100009818592 [0,0,0,0,1,1|2,0,0]=4 2706 B14R2.1264 C[C@@H](O)CSc1ccc2c(c1)CC2 62a_100009817552_100009818592 [0,0,0,0,1,1|2,0,0]=4 2707 B14R2.1264 C[C@@H](O)CSc1ccc2c(c1)CC2 62a_100009818592_100009817552 [0,0,0,0,1,1|2,0,0]=4 2708 B16R2.477 C=C(C)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000748629 [0,0,0,0,0,2|1,0,1]=4 2709 B16R2.477 C=C(C)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000748629 [0,0,0,0,0,2|1,0,1]=4 2710 B16R2.477 C=C(C)COc1ccc2c(c1)OCCO2 34a_100000234341_100000748629 [0,0,0,0,0,2|1,0,1]=4 2711 B16R2.477 C=C(C)CSc1ccc2c(c1)OCCO2 62a_100000748629_100011216881 [0,0,0,0,0,2|1,0,1]=4 2712 B16R2.477 C=C(C)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000211660 [0,0,0,0,0,2|1,0,1]=4 2713 B16R2.477 CC(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200000210301 [0,0,0,0,0,2|1,0,1]=4 2714 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 11a_100000684186_100015343762 [0,0,0,0,0,2|1,0,1]=4 2715 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 1626a_100000684186_100015343762 [0,0,0,0,0,2|1,0,1]=4 2716 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 240690a_100000684186_100015343762 [0,0,0,0,0,2|1,0,1]=4 2717 B16R2.477 CC(=O)NCc1ccc2c(c1)OCCO2 527a_100000684186_100103153847 [0,0,0,0,0,2|1,0,1]=4 2718 B16R2.477 CC(C)C=Cc1ccc2c(c1)OCCO2 271570a_100016257149_100000184379 [0,0,0,0,0,2|1,0,1]=4 2719 B16R2.477 CC(C)CNc1ccc2c(c1)CCCO2 2230a_100138412508_100000210760 [0,0,0,0,0,2|2,0,0]=4 2720 B16R2.477 CC(C)CNc1ccc2c(c1)CCCO2 34a_100138412508_100000210624 [0,0,0,0,0,2|2,0,0]=4 2721 B16R2.477 CC(C)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000210760 [0,0,0,0,0,2|1,0,0]=3 2722 B16R2.477 CC(C)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000210624 [0,0,0,0,0,2|1,0,0]=3 2723 B16R2.477 CC(C)COc1ccc2c(c1)CCOC2 34a_100009841951_100000210624 [0,0,0,0,0,2|2,0,0]=4 2724 B16R2.477 CC(C)COc1ccc2c(c1)CCOC2 7a_100009841951_100000210760 [0,0,0,0,0,2|2,0,0]=4 2725 B16R2.477 CC(C)COc1ccc2c(c1)NCCO2 34a_100020636358_100000210624 [0,0,0,0,0,2|2,0,0]=4 2726 B16R2.477 CC(C)COc1ccc2c(c1)OCCO2 34a_100000234341_100000210624 [0,0,0,0,0,2|1,0,0]=3 2727 B16R2.477 CC(C)CSc1ccc2c(c1)CCCO2 62a_100000210624_100011393166 [0,0,0,0,0,2|2,0,0]=4 2728 B16R2.477 CC(C)CSc1ccc2c(c1)CCCO2 62a_100011393166_100000210760 [0,0,0,0,0,2|2,0,0]=4 2729 B16R2.477 CC(C)CSc1ccc2c(c1)COCC2 62a_100000210624_100010128096 [0,0,0,0,0,2|2,0,0]=4 2730 B16R2.477 CC(C)CSc1ccc2c(c1)COCC2 62a_100010128096_100000210760 [0,0,0,0,0,2|2,0,0]=4 2731 B16R2.477 CC(C)CSc1ccc2c(c1)NCCO2 62a_100000210624_100000708519 [0,0,0,0,0,2|2,0,0]=4 2732 B16R2.477 CC(C)CSc1ccc2c(c1)OCCC2 62a_100000210624_100010700467 [0,0,0,0,0,2|2,0,0]=4 2733 B16R2.477 CC(C)CSc1ccc2c(c1)OCCC2 62a_100010700467_100000210760 [0,0,0,0,0,2|2,0,0]=4 2734 B16R2.477 CC(C)CSc1ccc2c(c1)OCCN2 62a_100000210624_100012355470 [0,0,0,0,0,2|2,0,0]=4 2735 B16R2.477 CC(C)CSc1ccc2c(c1)OCCO2 62a_100000210624_100011216881 [0,0,0,0,0,2|1,0,0]=3 2736 B16R2.477 CC(C)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000210760 [0,0,0,0,0,2|1,0,0]=3 2737 B16R2.477 CC(C)NCc1ccc2c(c1)CCCO2 207a_100138425928_100011934692 [0,0,0,0,0,2|2,0,0]=4 2738 B16R2.477 CC(C)NCc1ccc2c(c1)OCCO2 207a_100138425928_100000184955 [0,0,0,0,0,2|1,0,0]=3 2739 B16R2.477 CC(C)NCc1ccc2c(c1)OCCO2 2230a_100000684186_100000210206 [0,0,0,0,0,2|1,0,0]=3 2740 B16R2.477 CC(C)NCc1ccc2c(c1)OCCO2 34a_100000684186_100000210206 [0,0,0,0,0,2|1,0,0]=3 2741 B16R2.477 CC(C)NCc1ccc2c(n1)OCCO2 207a_100138425928_100009856165 [0,0,0,0,0,2|2,0,0]=4 2742 B16R2.477 CC(C)OCc1ccc2c(c1)OCCO2 34a_100000745213_100000210206 [0,0,0,0,0,2|1,0,0]=3 2743 B16R2.477 CC(O)C=Cc1ccc2c(c1)OCCO2 271570a_200011019289_100000184379 [0,0,0,0,0,2|1,0,1]=4 2744 B16R2.477 CC(O)CNc1ccc2c(c1)CCCO2 2230a_100138412508_100011218427 [0,0,0,0,0,2|2,0,0]=4 2745 B16R2.477 CC(O)CNc1ccc2c(c1)CCCO2 34a_100138412508_100011218427 [0,0,0,0,0,2|2,0,0]=4 2746 B16R2.477 CC(O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100011218427 [0,0,0,0,0,2|1,0,0]=3 2747 B16R2.477 CC(O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100011218427 [0,0,0,0,0,2|1,0,0]=3 2748 B16R2.477 CC(O)COc1ccc2c(c1)CCOC2 34a_100009841951_100011218427 [0,0,0,0,0,2|2,0,0]=4 2749 B16R2.477 CC(O)COc1ccc2c(c1)CCOC2 7a_100009841951_100011218427 [0,0,0,0,0,2|2,0,0]=4 2750 B16R2.477 CC(O)COc1ccc2c(c1)NCCO2 34a_100020636358_100011218427 [0,0,0,0,0,2|2,0,0]=4 2751 B16R2.477 CC(O)COc1ccc2c(c1)OCCO2 34a_100000234341_100011218427 [0,0,0,0,0,2|1,0,0]=3 2752 B16R2.477 CC(O)CSc1ccc2c(c1)CCCO2 62a_100011218427_100011393166 [0,0,0,0,0,2|2,0,0]=4 2753 B16R2.477 CC(O)CSc1ccc2c(c1)CCCO2 62a_100011393166_100011218427 [0,0,0,0,0,2|2,0,0]=4 2754 B16R2.477 CC(O)CSc1ccc2c(c1)COCC2 62a_100010128096_100011218427 [0,0,0,0,0,2|2,0,0]=4 2755 B16R2.477 CC(O)CSc1ccc2c(c1)COCC2 62a_100011218427_100010128096 [0,0,0,0,0,2|2,0,0]=4 2756 B16R2.477 CC(O)CSc1ccc2c(c1)NCCO2 62a_100011218427_100000708519 [0,0,0,0,0,2|2,0,0]=4 2757 B16R2.477 CC(O)CSc1ccc2c(c1)OCCC2 62a_100010700467_100011218427 [0,0,0,0,0,2|2,0,0]=4 2758 B16R2.477 CC(O)CSc1ccc2c(c1)OCCC2 62a_100011218427_100010700467 [0,0,0,0,0,2|2,0,0]=4 2759 B16R2.477 CC(O)CSc1ccc2c(c1)OCCN2 62a_100011218427_100012355470 [0,0,0,0,0,2|2,0,0]=4 2760 B16R2.477 CC(O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100011218427 [0,0,0,0,0,2|1,0,0]=3 2761 B16R2.477 CC(O)CSc1ccc2c(c1)OCCO2 62a_100011218427_100011216881 [0,0,0,0,0,2|1,0,0]=3 2762 B16R2.477 C[C@@H](O)CNc1ccc2c(c1)CCCO2 2230a_100138412508_100009817552 [0,0,0,0,0,2|2,0,0]=4 2763 B16R2.477 C[C@@H](O)CNc1ccc2c(c1)CCCO2 34a_100138412508_100009817552 [0,0,0,0,0,2|2,0,0]=4 2764 B16R2.477 C[C@@H](O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100009817552 [0,0,0,0,0,2|1,0,0]=3 2765 B16R2.477 C[C@@H](O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100009817552 [0,0,0,0,0,2|1,0,0]=3 2766 B16R2.477 C[C@@H](O)COc1ccc2c(c1)CCOC2 34a_100009841951_100009817552 [0,0,0,0,0,2|2,0,0]=4 2767 B16R2.477 C[C@@H](O)COc1ccc2c(c1)CCOC2 7a_100009841951_100009817552 [0,0,0,0,0,2|2,0,0]=4 2768 B16R2.477 C[C@@H](O)COc1ccc2c(c1)NCCO2 34a_100020636358_100009817552 [0,0,0,0,0,2|2,0,0]=4 2769 B16R2.477 C[C@@H](O)COc1ccc2c(c1)OCCO2 34a_100000234341_100009817552 [0,0,0,0,0,2|1,0,0]=3 2770 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)CCCO2 62a_100009817552_100011393166 [0,0,0,0,0,2|2,0,0]=4 2771 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)CCCO2 62a_100011393166_100009817552 [0,0,0,0,0,2|2,0,0]=4 2772 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)COCC2 62a_100009817552_100010128096 [0,0,0,0,0,2|2,0,0]=4 2773 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)COCC2 62a_100010128096_100009817552 [0,0,0,0,0,2|2,0,0]=4 2774 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)NCCO2 62a_100009817552_100000708519 [0,0,0,0,0,2|2,0,0]=4 2775 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)OCCC2 62a_100009817552_100010700467 [0,0,0,0,0,2|2,0,0]=4 2776 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)OCCC2 62a_100010700467_100009817552 [0,0,0,0,0,2|2,0,0]=4 2777 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)OCCN2 62a_100009817552_100012355470 [0,0,0,0,0,2|2,0,0]=4 2778 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)OCCO2 62a_100009817552_100011216881 [0,0,0,0,0,2|1,0,0]=3 2779 B16R2.477 C[C@@H](O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100009817552 [0,0,0,0,0,2|1,0,0]=3 2780 B16R2.477 FC(F)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100011934356 [0,0,0,0,0,2|2,0,0]=4 2781 B16R2.477 FC(F)CNc1ccc2c(c1)OCCO2 34a_100020630400_100011934356 [0,0,0,0,0,2|2,0,0]=4 2782 B16R2.477 FC(F)COc1ccc2c(c1)OCCO2 34a_100000234341_100011934356 [0,0,0,0,0,2|2,0,0]=4 2783 B16R2.477 FC(F)CSc1ccc2c(c1)OCCO2 62a_100011216881_100011934356 [0,0,0,0,0,2|2,0,0]=4 2784 B16R2.477 FC(F)CSc1ccc2c(c1)OCCO2 62a_100011934356_100011216881 [0,0,0,0,0,2|2,0,0]=4 2785 B16R2.477 NC(=O)CNc1ccc2c(c1)OCCO2 2230a_100020630400_100000747473 [0,0,0,0,0,2|1,0,1]=4 2786 B16R2.477 NC(=O)CNc1ccc2c(c1)OCCO2 34a_100020630400_100000187820 [0,0,0,0,0,2|1,0,1]=4 2787 B16R2.477 NC(=O)COc1ccc2c(c1)OCCO2 34a_100000234341_100000187820 [0,0,0,0,0,2|1,0,1]=4 2788 B16R2.477 NC(=O)CSc1ccc2c(c1)OCCO2 62a_100000747473_100011216881 [0,0,0,0,0,2|1,0,1]=4 2789 B16R2.477 NC(=O)CSc1ccc2c(c1)OCCO2 62a_100011216881_100000747473 [0,0,0,0,0,2|1,0,1]=4 2790 B16R2.477 [13CH3]C(=O)CSc1ccc2c(c1)OCCO2 1458a_100000179515_200025704644 [0,0,0,0,0,2|1,0,1]=4 2791 B16R2.180342 CC(=O)Cc1ccc2c(c1)OCCCO2 1458a_100000070787_100000742768 [0,0,0,0,0,2|1,0,1]=4 2792 B16R2.180342 CC(C)Nc1ccc2c(c1)OCCCO2 2230a_100000181267_100000210206 [0,0,0,0,0,2|2,0,0]=4 2793 B16R2.180342 CC(C)Nc1ccc2c(c1)OCCCO2 34a_100000181267_100000210206 [0,0,0,0,0,2|2,0,0]=4 2794 B16R2.180342 CC(C)Sc1ccc2c(c1)OCCCO2 62a_100000210206_100000739260 [0,0,0,0,0,2|2,0,0]=4 2795 B16R2.180342 CC(C)Sc1ccc2c(c1)OCCCO2 62a_100000739260_100000210206 [0,0,0,0,0,2|2,0,0]=4 2796 B16R2.180342 CN(C)Cc1ccc2c(c1)OCCCO2 2230a_100102631434_100000742768 [0,0,0,0,0,2|2,0,0]=4 2797 B16R2.180342 CN(C)Cc1ccc2c(c1)OCCCO2 269982a_100102631434_100000742768 [0,0,0,0,0,2|2,0,0]=4 2798 B16R2.180342 CN(C)Cc1ccc2c(c1)OCCCO2 270004a_100102631434_100000742767 [0,0,0,0,0,2|2,0,0]=4 2799 B16R2.27160 C=C(C)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000730704 [0,0,0,0,0,2|1,0,1]=4 2800 B16R2.27160 C=C(C)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000730704 [0,0,0,0,0,2|1,0,1]=4 2801 B16R2.27160 C=C(C)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000730704 [0,0,0,0,0,2|1,0,1]=4 2802 B16R2.27160 C=C(C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000748629 [0,0,0,0,0,2|1,0,1]=4 2803 B16R2.27160 C=C(C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000748629 [0,0,0,0,0,2|1,0,1]=4 2804 B16R2.27160 C=C(C)COCc1ccc2c(c1)OCO2 34a_100000210245_100000189651 [0,0,0,0,0,2|1,0,1]=4 2805 B16R2.27160 C=C(C)COCc1ccc2c(c1)OCO2 34a_100000210967_100000748629 [0,0,0,0,0,2|1,0,1]=4 2806 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 2230a_100000209953_100000761012 [0,0,0,0,0,2|1,0,1]=4 2807 B16R2.27160 CC(=CCNc1ccc2c(c1)OCO2)C 34a_100000209953_100000761012 [0,0,0,0,0,2|1,0,1]=4 2808 B16R2.27160 CC(=CCOc1ccc2c(c1)OCO2)C 34a_100000210298_100000761012 [0,0,0,0,0,2|1,0,1]=4 2809 B16R2.27160 CC(=O)COCc1ccc2c(c1)OCO2 34a_100000211253_100000189651 [0,0,0,0,0,2|1,0,1]=4 2810 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 11a_100000204656_100015343762 [0,0,0,0,0,2|1,0,1]=4 2811 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 1626a_100000204656_100015343762 [0,0,0,0,0,2|1,0,1]=4 2812 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 240690a_100000204656_100015343762 [0,0,0,0,0,2|1,0,1]=4 2813 B16R2.27160 CC(=O)NCCc1ccc2c(c1)OCO2 527a_100000204656_100103153847 [0,0,0,0,0,2|1,0,1]=4 2814 B16R2.27160 CC(=O)OCNc1ccc2c(c1)OCO2 34a_100000209953_100009813279 [0,0,0,0,0,2|1,0,1]=4 2815 B16R2.27160 CC(=O)OCOc1ccc2c(c1)OCO2 34a_100000210298_100009813279 [0,0,0,0,0,2|1,0,1]=4 2816 B16R2.27160 CC(Br)COCc1ccc2c(c1)OCO2 34a_100012180447_100000189651 [0,0,0,0,0,2|1,0,0]=3 2817 B16R2.27160 CC(C)CC=Cc1ccc2c(c1)CCO2 271570a_100016259101_100000729065 [0,0,0,0,0,2|2,0,0]=4 2818 B16R2.27160 CC(C)CC=Cc1ccc2c(c1)OCC2 271570a_100016259101_100009818566 [0,0,0,0,0,2|2,0,0]=4 2819 B16R2.27160 CC(C)CC=Cc1ccc2c(c1)OCO2 271570a_100016259101_100000688060 [0,0,0,0,0,2|1,0,0]=3 2820 B16R2.27160 CC(C)CCNc1ccc2c(c1)CCO2 2230a_100000736984_100000210312 [0,0,0,0,0,2|2,0,0]=4 2821 B16R2.27160 CC(C)CCNc1ccc2c(c1)CCO2 34a_100000736984_100000210312 [0,0,0,0,0,2|2,0,0]=4 2822 B16R2.27160 CC(C)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000210312 [0,0,0,0,0,2|1,0,0]=3 2823 B16R2.27160 CC(C)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000210312 [0,0,0,0,0,2|1,0,0]=3 2824 B16R2.27160 CC(C)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000210312 [0,0,0,0,0,2|1,0,0]=3 2825 B16R2.27160 CC(C)CCSc1ccc2c(c1)CCO2 62a_100000210312_100000729065 [0,0,0,0,0,2|2,0,0]=4 2826 B16R2.27160 CC(C)CCSc1ccc2c(c1)CCO2 62a_100000729065_100000210312 [0,0,0,0,0,2|2,0,0]=4 2827 B16R2.27160 CC(C)CCSc1ccc2c(c1)OCC2 62a_100000210312_100009818566 [0,0,0,0,0,2|2,0,0]=4 2828 B16R2.27160 CC(C)CCSc1ccc2c(c1)OCC2 62a_100009818566_100000210312 [0,0,0,0,0,2|2,0,0]=4 2829 B16R2.27160 CC(C)CNCc1ccc2c(c1)CCO2 207a_100000210953_100011218456 [0,0,0,0,0,2|2,0,0]=4 2830 B16R2.27160 CC(C)CNCc1ccc2c(c1)CCO2 2230a_100011219410_100000210760 [0,0,0,0,0,2|2,0,0]=4 2831 B16R2.27160 CC(C)CNCc1ccc2c(c1)CCO2 270004a_100000210953_100011218456 [0,0,0,0,0,2|2,0,0]=4 2832 B16R2.27160 CC(C)CNCc1ccc2c(c1)CCO2 270004a_100011219410_100000210432 [0,0,0,0,0,2|2,0,0]=4 2833 B16R2.27160 CC(C)CNCc1ccc2c(c1)CCO2 34a_100011219410_100000210624 [0,0,0,0,0,2|2,0,0]=4 2834 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000210760 [0,0,0,0,0,2|1,0,0]=3 2835 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 270004a_100000210006_100000210432 [0,0,0,0,0,2|1,0,0]=3 2836 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000210624 [0,0,0,0,0,2|1,0,0]=3 2837 B16R2.27160 CC(C)CNCc1ccc2c(c1)OCO2 34a_100000210953_100000189651 [0,0,0,0,0,2|1,0,0]=3 2838 B16R2.27160 CC(C)COCc1ccc2c(c1)CCO2 34a_100011219353_100000210624 [0,0,0,0,0,2|2,0,0]=4 2839 B16R2.27160 CC(C)COCc1ccc2c(c1)CCO2 7a_100011219353_100000210760 [0,0,0,0,0,2|2,0,0]=4 2840 B16R2.27160 CC(C)COCc1ccc2c(c1)OCO2 34a_100000210257_100000189651 [0,0,0,0,0,2|1,0,0]=3 2841 B16R2.27160 CC(C)COCc1ccc2c(c1)OCO2 34a_100000210967_100000210624 [0,0,0,0,0,2|1,0,0]=3 2842 B16R2.27160 CC(C)NCCc1ccc2c(c1)CCO2 2230a_100138425928_100000763274 [0,0,0,0,0,2|2,0,0]=4 2843 B16R2.27160 CC(C)NCCc1ccc2c(c1)CCO2 34a_100138425928_100000763274 [0,0,0,0,0,2|2,0,0]=4 2844 B16R2.27160 CC(C)NCCc1ccc2c(c1)OCO2 2230a_100000204656_100000210206 [0,0,0,0,0,2|1,0,0]=3 2845 B16R2.27160 CC(C)NCCc1ccc2c(c1)OCO2 34a_100000204656_100000210206 [0,0,0,0,0,2|1,0,0]=3 2846 B16R2.27160 CC(C)OCCc1ccc2c(c1)CCO2 34a_100000212225_100000763274 [0,0,0,0,0,2|2,0,0]=4 2847 B16R2.27160 CC(C)OCCc1ccc2c(c1)CCO2 34a_100012161074_100000210206 [0,0,0,0,0,2|2,0,0]=4 2848 B16R2.27160 CC(C)OCCc1ccc2c(c1)CCO2 7a_100012161074_100000210206 [0,0,0,0,0,2|2,0,0]=4 2849 B16R2.27160 CC(C)OCCc1ccc2c(c1)OCO2 34a_100011934097_100000210206 [0,0,0,0,0,2|1,0,0]=3 2850 B16R2.27160 CC(C)OCNc1ccc2c(c1)CCO2 2230a_100000736984_100000709892 [0,0,0,0,0,2|2,0,0]=4 2851 B16R2.27160 CC(C)OCNc1ccc2c(c1)CCO2 34a_100000736984_100000709892 [0,0,0,0,0,2|2,0,0]=4 2852 B16R2.27160 CC(C)OCNc1ccc2c(c1)OCO2 2230a_100000209953_100000709892 [0,0,0,0,0,2|1,0,0]=3 2853 B16R2.27160 CC(C)OCNc1ccc2c(c1)OCO2 34a_100000209953_100000709892 [0,0,0,0,0,2|1,0,0]=3 2854 B16R2.27160 CC(C)OCOc1ccc2c(c1)OCO2 34a_100000210298_100000709892 [0,0,0,0,0,2|1,0,0]=3 2855 B16R2.27160 CC(C)OCSc1ccc2c(c1)CCO2 62a_100000709892_100000729065 [0,0,0,0,0,2|2,0,0]=4 2856 B16R2.27160 CC(C)OCSc1ccc2c(c1)CCO2 62a_100000729065_100000709892 [0,0,0,0,0,2|2,0,0]=4 2857 B16R2.27160 CC(C)OCSc1ccc2c(c1)OCC2 62a_100000709892_100009818566 [0,0,0,0,0,2|2,0,0]=4 2858 B16R2.27160 CC(C)OCSc1ccc2c(c1)OCC2 62a_100009818566_100000709892 [0,0,0,0,0,2|2,0,0]=4 2859 B16R2.27160 CC(C)SCCc1ccc2c(c1)CCO2 62a_100000210206_100000763274 [0,0,0,0,0,2|2,0,0]=4 2860 B16R2.27160 CC(C)SCCc1ccc2c(c1)CCO2 62a_100000763274_100000210206 [0,0,0,0,0,2|2,0,0]=4 2861 B16R2.27160 CC(F)COCc1ccc2c(c1)OCO2 34a_100015925927_100000189651 [0,0,0,0,0,2|1,0,0]=3 2862 B16R2.27160 CC(O)CCNc1ccc2c(c1)CCO2 2230a_100000736984_100012276601 [0,0,0,0,0,2|2,0,0]=4 2863 B16R2.27160 CC(O)CCNc1ccc2c(c1)CCO2 34a_100000736984_100012276601 [0,0,0,0,0,2|2,0,0]=4 2864 B16R2.27160 CC(O)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100012276601 [0,0,0,0,0,2|1,0,0]=3 2865 B16R2.27160 CC(O)CCNc1ccc2c(c1)OCO2 34a_100000209953_100012276601 [0,0,0,0,0,2|1,0,0]=3 2866 B16R2.27160 CC(O)CCOc1ccc2c(c1)OCO2 34a_100000210298_100012276601 [0,0,0,0,0,2|1,0,0]=3 2867 B16R2.27160 CC(O)CCSc1ccc2c(c1)CCO2 62a_100000729065_100012276601 [0,0,0,0,0,2|2,0,0]=4 2868 B16R2.27160 CC(O)CCSc1ccc2c(c1)CCO2 62a_100012276601_100000729065 [0,0,0,0,0,2|2,0,0]=4 2869 B16R2.27160 CC(O)CCSc1ccc2c(c1)OCC2 62a_100009818566_100012276601 [0,0,0,0,0,2|2,0,0]=4 2870 B16R2.27160 CC(O)CCSc1ccc2c(c1)OCC2 62a_100012276601_100009818566 [0,0,0,0,0,2|2,0,0]=4 2871 B16R2.27160 CC(O)CNCc1ccc2c(c1)CCO2 207a_100000210904_100011218456 [0,0,0,0,0,2|2,0,0]=4 2872 B16R2.27160 CC(O)CNCc1ccc2c(c1)CCO2 2230a_100011219410_100011218427 [0,0,0,0,0,2|2,0,0]=4 2873 B16R2.27160 CC(O)CNCc1ccc2c(c1)CCO2 270004a_100000210904_100011218456 [0,0,0,0,0,2|2,0,0]=4 2874 B16R2.27160 CC(O)CNCc1ccc2c(c1)CCO2 34a_100011219410_100011218427 [0,0,0,0,0,2|2,0,0]=4 2875 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100011218427 [0,0,0,0,0,2|1,0,0]=3 2876 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100011218427 [0,0,0,0,0,2|1,0,0]=3 2877 B16R2.27160 CC(O)CNCc1ccc2c(c1)OCO2 34a_100000210904_100000189651 [0,0,0,0,0,2|1,0,0]=3 2878 B16R2.27160 CC(O)COCc1ccc2c(c1)CCO2 34a_100011219353_100011218427 [0,0,0,0,0,2|2,0,0]=4 2879 B16R2.27160 CC(O)COCc1ccc2c(c1)CCO2 7a_100011219353_100011218427 [0,0,0,0,0,2|2,0,0]=4 2880 B16R2.27160 CC(O)COCc1ccc2c(c1)OCO2 34a_100000210967_100011218427 [0,0,0,0,0,2|1,0,0]=3 2881 B16R2.27160 C[C@@H](Cl)COCc1ccc2c(c1)OCO2 34a_100016084084_100000189651 [0,0,0,0,0,2|1,0,0]=3 2882 B16R2.27160 C[C@@H](N)COCc1ccc2c(c1)OCO2 34a_100000737577_100000189651 [0,0,0,0,0,2|0,0,0]=2 2883 B16R2.27160 C[C@@H](N)COCc1ccc2ncoc2c1 34a_100000737577_106359897996 [0,0,0,0,0,2|1,0,1]=4 2884 B16R2.27160 C[C@@H](N)COCc1ccc2ocnc2c1 34a_100000737577_200010203175 [0,0,0,0,0,2|1,0,1]=4 2885 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)CCO2 2230a_100011219410_100009817552 [0,0,0,0,0,2|2,0,0]=4 2886 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)CCO2 34a_100011219410_100009817552 [0,0,0,0,0,2|2,0,0]=4 2887 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100009817552 [0,0,0,0,0,2|1,0,0]=3 2888 B16R2.27160 C[C@@H](O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100009817552 [0,0,0,0,0,2|1,0,0]=3 2889 B16R2.27160 C[C@@H](O)COCc1ccc2c(c1)CCO2 34a_100011219353_100009817552 [0,0,0,0,0,2|2,0,0]=4 2890 B16R2.27160 C[C@@H](O)COCc1ccc2c(c1)CCO2 7a_100011219353_100009817552 [0,0,0,0,0,2|2,0,0]=4 2891 B16R2.27160 C[C@@H](O)COCc1ccc2c(c1)OCO2 34a_100000210967_100009817552 [0,0,0,0,0,2|1,0,0]=3 2892 B16R2.27160 FC(F)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100011934356 [0,0,0,0,0,2|2,0,0]=4 2893 B16R2.27160 FC(F)CNCc1ccc2c(c1)OCO2 34a_100000210006_100011934356 [0,0,0,0,0,2|2,0,0]=4 2894 B16R2.27160 FC(F)CNCc1ccc2c(c1)OCO2 34a_100000765723_100000189651 [0,0,0,0,0,2|2,0,0]=4 2895 B16R2.27160 FC(F)COCc1ccc2c(c1)OCO2 34a_100000210967_100011934356 [0,0,0,0,0,2|2,0,0]=4 2896 B16R2.27160 FC(F)COCc1ccc2c(c1)OCO2 34a_100000743014_100000189651 [0,0,0,0,0,2|2,0,0]=4 2897 B16R2.27160 NC(=O)CCNc1ccc2c(c1)OCO2 2230a_100000209953_100000744528 [0,0,0,0,0,2|1,0,1]=4 2898 B16R2.27160 NC(=O)CCNc1ccc2c(c1)OCO2 34a_100000209953_100000731001 [0,0,0,0,0,2|1,0,1]=4 2899 B16R2.27160 NC(=O)CCOc1ccc2c(c1)OCO2 34a_100000210298_100000731001 [0,0,0,0,0,2|1,0,1]=4 2900 B16R2.27160 NC(=O)CNCc1ccc2c(c1)OCO2 2230a_100000210006_100000747473 [0,0,0,0,0,2|1,0,1]=4 2901 B16R2.27160 NC(=O)CNCc1ccc2c(c1)OCO2 34a_100000210006_100000187820 [0,0,0,0,0,2|1,0,1]=4 2902 B16R2.27160 NC(=O)COCc1ccc2c(c1)OCO2 34a_100000210967_100000187820 [0,0,0,0,0,2|1,0,1]=4