0 B17R2.5711 CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000070787_100011216954 [0,0,0,0,0,0|1,0,0]=1 1 B17R2.5711 CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_200000210301 [0,0,0,0,0,0|1,0,0]=1 2 B17R2.5711 CN(C)C(c1ccccc1)c2ccccc2 2230a_100102631434_100000211591 [0,0,0,0,0,0|3,0,0]=3 3 B17R2.5711 CN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_200000210301 [0,0,0,0,0,0|3,0,0]=3 4 B17R2.5711 CN(C)C(c1ccccc1)c2ccccc2 269982a_100102631434_100000211591 [0,0,0,0,0,0|3,0,0]=3 5 B17R2.5711 CN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_200000210301 [0,0,0,0,0,0|3,0,0]=3 6 B17R2.5711 CN(C)C(c1ccccc1)c2ccccc2 270004a_100102631434_100000210122 [0,0,0,0,0,0|3,0,0]=3 7 B17R2.5711 CN(C)C(c1ccccc1)c2ccccn2 270004a_100102631434_100000210380 [0,0,0,0,0,0|4,0,0]=4 8 B17R2.5711 CN(C)C(c1ccccc1)c2cccnc2 270004a_100102631434_100000735413 [0,0,0,0,0,0|4,0,0]=4 9 B17R2.5711 CN([13CH3])C(c1ccccc1)c2ccccc2 2230a_100103148541_200025704644 [0,0,0,0,0,0|3,0,0]=3 10 B17R2.5711 CN([13CH3])C(c1ccccc1)c2ccccc2 269982a_100103148541_200025704644 [0,0,0,0,0,0|3,0,0]=3 11 B17R2.5711 [13CH3]C(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_200025704644 [0,0,0,0,0,0|1,0,0]=1 12 B16R2.187 CNC(c1ccccc1)c2ccccc2 2230a_100000162943_200000210301 [1,0,0,0,0,0|2,0,0]=3 13 B16R2.187 CNC(c1ccccc1)c2ccccc2 2230a_106832991635_100000211591 [1,0,0,0,0,0|2,0,0]=3 14 B16R2.187 CNC(c1ccccc1)c2ccccc2 270004a_106832991635_100000210122 [1,0,0,0,0,0|2,0,0]=3 15 B16R2.187 CNC(c1ccccc1)c2ccccc2 34a_100000162943_200000210301 [1,0,0,0,0,0|2,0,0]=3 16 B16R2.187 CNC(c1ccccc1)c2ccccc2 7a_106832991635_100011216954 [1,0,0,0,0,0|2,0,0]=3 17 B16R2.187 CNC(c1ccccc1)c2ccccn2 2230a_100000689936_200000210301 [1,0,0,0,0,0|3,0,0]=4 18 B16R2.187 CNC(c1ccccc1)c2ccccn2 270004a_106832991635_100000210380 [1,0,0,0,0,0|3,0,0]=4 19 B16R2.187 CNC(c1ccccc1)c2cccnc2 2230a_100011232609_200000210301 [1,0,0,0,0,0|3,0,0]=4 20 B16R2.187 CNC(c1ccccc1)c2cccnc2 270004a_106832991635_100000735413 [1,0,0,0,0,0|3,0,0]=4 21 B16R2.187 CNC(c1ccccc1)c2ccncc2 2230a_100025760769_200000210301 [1,0,0,0,0,0|3,0,0]=4 22 B16R2.187 COC(c1ccccc1)c2ccccc2 34a_100000211180_200000210301 [1,0,0,0,0,0|2,0,0]=3 23 B16R2.187 COC(c1ccccc1)c2ccccc2 7a_100000211180_200000210301 [1,0,0,0,0,0|2,0,0]=3 24 B16R2.187 COC(c1ccccc1)c2ccccn2 7a_100000180852_200000210301 [1,0,0,0,0,0|3,0,0]=4 25 B16R2.187 CSC(c1ccccc1)c2ccccc2 62a_100000211591_200000210301 [1,0,0,0,0,0|2,0,0]=3 26 B16R2.187 CSC(c1ccccc1)c2ccccc2 62a_200000210301_100011216954 [1,0,0,0,0,0|2,0,0]=3 27 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccc2 2230a_100000162943_200025704644 [1,0,0,0,0,0|2,0,0]=3 28 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccc2 34a_100000162943_200025704644 [1,0,0,0,0,0|2,0,0]=3 29 B16R2.187 [13CH3]NC(c1ccccc1)c2ccccn2 2230a_100000689936_200025704644 [1,0,0,0,0,0|3,0,0]=4 30 B16R2.187 [13CH3]NC(c1ccccc1)c2cccnc2 2230a_100011232609_200025704644 [1,0,0,0,0,0|3,0,0]=4 31 B16R2.187 [13CH3]NC(c1ccccc1)c2ccncc2 2230a_100025760769_200025704644 [1,0,0,0,0,0|3,0,0]=4 32 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccc2 34a_100000211180_200025704644 [1,0,0,0,0,0|2,0,0]=3 33 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccc2 7a_100000211180_200025704644 [1,0,0,0,0,0|2,0,0]=3 34 B16R2.187 [13CH3]OC(c1ccccc1)c2ccccn2 7a_100000180852_200025704644 [1,0,0,0,0,0|3,0,0]=4 35 B16R2.187 [13CH3]SC(c1ccccc1)c2ccccc2 62a_100000211591_200025704644 [1,0,0,0,0,0|2,0,0]=3 36 B16R2.187 [13CH3]SC(c1ccccc1)c2ccccc2 62a_200025704644_100011216954 [1,0,0,0,0,0|2,0,0]=3 37 B18R2.2312 C#CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000211873_100011216954 [0,1,0,0,0,0|1,0,0]=2 38 B18R2.2312 C=CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000185746_100011216954 [0,1,0,0,0,0|1,0,0]=2 39 B18R2.2312 CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210414_100011216954 [0,1,0,0,0,0|1,0,0]=2 40 B18R2.2312 CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210202 [0,1,0,0,0,0|1,0,0]=2 41 B18R2.2312 CCN(C)C(c1ccccc1)c2ccccc2 2230a_100000225621_100000211591 [0,1,0,0,0,0|3,0,0]=4 42 B18R2.2312 CCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000210202 [0,1,0,0,0,0|3,0,0]=4 43 B18R2.2312 CCN(C)C(c1ccccc1)c2ccccc2 269982a_100000225621_100000211591 [0,1,0,0,0,0|3,0,0]=4 44 B18R2.2312 CCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000204670 [0,1,0,0,0,0|3,0,0]=4 45 B18R2.2312 CN(CF)C(c1ccccc1)c2ccccc2 269982a_100103148541_100015361967 [0,1,0,0,0,0|3,0,0]=4 46 B18R2.2312 CNC(=O)C(c1ccccc1)c2ccccc2 11a_106832991635_100000210944 [0,1,0,0,0,0|1,0,0]=2 47 B18R2.2312 CNC(=O)C(c1ccccc1)c2ccccc2 1626a_100102657272_100000210944 [0,1,0,0,0,0|1,0,0]=2 48 B18R2.2312 CNC(=O)C(c1ccccc1)c2ccccc2 240690a_100102657272_100000210944 [0,1,0,0,0,0|1,0,0]=2 49 B18R2.2312 CNC(=O)C(c1ccccc1)c2ccccc2 527a_100102657272_100000210944 [0,1,0,0,0,0|1,0,0]=2 50 B18R2.2312 O=C(CF)C(c1ccccc1)c2ccccc2 1458a_100000210944_100015361967 [0,1,0,0,0,0|1,0,0]=2 51 B18R2.2312 O=C(CO)C(c1ccccc1)c2ccccc2 1458a_100000210174_100011216954 [0,1,0,0,0,0|0,0,0]=1 52 B18R2.5988 CN(C)C(c1ccccc1)c2ccccc2Br 270004a_100102631434_100000198044 [0,1,0,0,0,0|3,0,0]=4 53 B18R2.5988 CN(C)C(c1ccccc1)c2ccccc2Cl 270004a_100102631434_100011215288 [0,1,0,0,0,0|3,0,0]=4 54 B18R2.5988 CN(C)C(c1ccccc1)c2ccccc2F 270004a_100102631434_100011217773 [0,1,0,0,0,0|3,0,0]=4 55 B18R2.5988 Cc1ccccc1C(c2ccccc2)N(C)C 2230a_100102631434_100000230135 [0,1,0,0,0,0|3,0,0]=4 56 B18R2.5988 Cc1ccccc1C(c2ccccc2)N(C)C 269982a_100102631434_100000230135 [0,1,0,0,0,0|3,0,0]=4 57 B18R2.5988 Cc1ccccc1C(c2ccccc2)N(C)C 270004a_100102631434_100000735561 [0,1,0,0,0,0|3,0,0]=4 58 B18R2.7127 CC(=O)C(C)(c1ccccc1)c2ccccc2 1458a_100000752439_200000210301 [0,1,0,0,0,0|1,0,0]=2 59 B18R2.7127 CC(C(=O)[13CH3])(c1ccccc1)c2ccccc2 1458a_100000752439_200025704644 [0,1,0,0,0,0|1,0,0]=2 60 B18R2.9267 CN(C)C(c1ccccc1)c2ccc(cc2)Br 270004a_100102631434_100000718703 [0,1,0,0,0,0|3,0,0]=4 61 B18R2.9267 CN(C)C(c1ccccc1)c2ccc(cc2)Cl 2230a_100102631434_100000211669 [0,1,0,0,0,0|3,0,0]=4 62 B18R2.9267 CN(C)C(c1ccccc1)c2ccc(cc2)Cl 269982a_100102631434_100000211669 [0,1,0,0,0,0|3,0,0]=4 63 B18R2.9267 CN(C)C(c1ccccc1)c2ccc(cc2)Cl 270004a_100102631434_100000211064 [0,1,0,0,0,0|3,0,0]=4 64 B18R2.9267 CN(C)C(c1ccccc1)c2ccc(cc2)F 270004a_100102631434_100000210425 [0,1,0,0,0,0|3,0,0]=4 65 B18R2.9267 Cc1ccc(cc1)C(c2ccccc2)N(C)C 270004a_100102631434_100000210966 [0,1,0,0,0,0|3,0,0]=4 66 B18R2.31034 CN(C)C(c1ccccc1)c2cccc(c2)Br 270004a_100102631434_100011267660 [0,1,0,0,0,0|3,0,0]=4 67 B18R2.31034 CN(C)C(c1ccccc1)c2cccc(c2)Cl 270004a_100102631434_100011215489 [0,1,0,0,0,0|3,0,0]=4 68 B18R2.31034 CN(C)C(c1ccccc1)c2cccc(c2)F 270004a_100102631434_200011219850 [0,1,0,0,0,0|3,0,0]=4 69 B18R2.31034 Cc1cccc(c1)C(c2ccccc2)N(C)C 270004a_100102631434_100011217825 [0,1,0,0,0,0|3,0,0]=4 70 B16R1.7878 C=CC=CC(=O)C(C(=O)C)c1ccccc1 1458a_100016291481_100009888967 [0,0,1,0,0,0|2,0,0]=3 71 B16R1.7878 C=CC=CC(=O)C(C(=O)N)c1ccccc1 1458a_100016291481_100000188848 [0,0,1,0,0,0|2,0,0]=3 72 B18R3.182 Cc1oc2ccccc2c1c3ccccc3 271570a_100011218836_200010236113 [0,0,0,1,0,0|1,0,1]=3 73 B18R3.182 Cc1oc2ccccc2c1c3ccccn3 271570a_100011264011_200010236113 [0,0,0,1,0,0|2,0,1]=4 74 B18R3.182 Cc1oc2ccccc2c1c3cccnc3 271570a_100000757648_200010236113 [0,0,0,1,0,0|2,0,1]=4 75 B18R3.182 Cc1oc2ccccc2c1c3ccncc3 271570a_100000752145_200010236113 [0,0,0,1,0,0|2,0,1]=4 76 B18R3.182 Cc1sc2ccccc2c1c3ccccc3 271570a_100011218836_100010002616 [0,0,0,1,0,0|1,1,1]=4 77 B18R3.993175 CC(=O)C1c2ccccc2-c3c1cccc3 1458a_100000182576_200000210301 [0,0,0,1,0,0|1,0,0]=2 78 B18R3.993175 CN(C)C1c2ccccc2-c3c1cccc3 2230a_100102631434_100000211598 [0,0,0,1,0,0|3,0,0]=4 79 B18R3.993175 CN(C)C1c2ccccc2-c3c1cccc3 269982a_100102631434_100000211598 [0,0,0,1,0,0|3,0,0]=4 80 B18R3.993175 [13CH3]C(=O)C1c2ccccc2-c3c1cccc3 1458a_100000182576_200025704644 [0,0,0,1,0,0|1,0,0]=2 81 B18R2.4111 CC(=O)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_200000210301 [0,0,0,0,0,1|1,0,1]=3 82 B18R2.4111 CC(=O)C(Cc1ccccc1)c2ccccc2 1458a_200000261918_200000210301 [0,0,0,0,0,1|1,0,0]=2 83 B18R2.4111 CC(=O)C(Oc1ccccc1)c2ccccc2 7a_100000210340_100009888967 [0,0,0,0,0,1|1,0,0]=2 84 B18R2.4111 CC(=O)C(Oc1cccnc1)c2ccccc2 7a_100000210849_100009888967 [0,0,0,0,0,1|2,0,0]=3 85 B18R2.4111 CC(=O)C(Oc1cncnc1)c2ccccc2 7a_100000754086_100009888967 [0,0,0,0,0,1|3,0,0]=4 86 B18R2.4111 CC(=O)C(Sc1ccccc1)c2ccccc2 1458a_100005462441_200000210301 [0,0,0,0,0,1|1,0,0]=2 87 B18R2.4111 CC(=O)C(Sc1ccccc1)c2ccccc2 62a_100000719477_100009888967 [0,0,0,0,0,1|1,0,0]=2 88 B18R2.4111 CC(=O)C(Sc1ccccc1)c2ccccc2 62a_100009888967_100000041952 [0,0,0,0,0,1|1,0,0]=2 89 B18R2.4111 CC(=O)C(Sc1ccccn1)c2ccccc2 62a_100009888967_100011216584 [0,0,0,0,0,1|2,0,0]=3 90 B18R2.4111 CC(=O)C(Sc1ccccn1)c2ccccc2 62a_100011216584_100009888967 [0,0,0,0,0,1|2,0,0]=3 91 B18R2.4111 CC(=O)C(Sc1cccnc1)c2ccccc2 62a_100000210063_100009888967 [0,0,0,0,0,1|2,0,0]=3 92 B18R2.4111 CC(=O)C(Sc1cccnc1)c2ccccc2 62a_100009888967_100000210063 [0,0,0,0,0,1|2,0,0]=3 93 B18R2.4111 CC(=O)C(Sc1cccnn1)c2ccccc2 62a_100009888967_100016991348 [0,0,0,0,0,1|3,0,0]=4 94 B18R2.4111 CC(=O)C(Sc1cccnn1)c2ccccc2 62a_100016991348_100009888967 [0,0,0,0,0,1|3,0,0]=4 95 B18R2.4111 CC(=O)C(Sc1ccncc1)c2ccccc2 62a_100000728582_100009888967 [0,0,0,0,0,1|2,0,0]=3 96 B18R2.4111 CC(=O)C(Sc1ccncc1)c2ccccc2 62a_100009888967_100000728582 [0,0,0,0,0,1|2,0,0]=3 97 B18R2.4111 CC(=O)C(Sc1ccncn1)c2ccccc2 62a_100000703185_100009888967 [0,0,0,0,0,1|3,0,0]=4 98 B18R2.4111 CC(=O)C(Sc1ccncn1)c2ccccc2 62a_100009888967_100000703185 [0,0,0,0,0,1|3,0,0]=4 99 B18R2.4111 CC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100000732662_100009888967 [0,0,0,0,0,1|3,0,0]=4 100 B18R2.4111 CC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100009888967_100000732662 [0,0,0,0,0,1|3,0,0]=4 101 B18R2.4111 CC(=O)C(Sc1cnccn1)c2ccccc2 62a_100000211759_100009888967 [0,0,0,0,0,1|3,0,0]=4 102 B18R2.4111 CC(=O)C(Sc1cnccn1)c2ccccc2 62a_100009888967_100000211759 [0,0,0,0,0,1|3,0,0]=4 103 B18R2.4111 CC(=O)C(Sc1cncnc1)c2ccccc2 62a_100009888967_100011206942 [0,0,0,0,0,1|3,0,0]=4 104 B18R2.4111 CC(=O)C(Sc1cncnc1)c2ccccc2 62a_100011206942_100009888967 [0,0,0,0,0,1|3,0,0]=4 105 B18R2.4111 CC(=O)C(Sc1ncccn1)c2ccccc2 62a_100000211032_100009888967 [0,0,0,0,0,1|3,0,0]=4 106 B18R2.4111 CC(=O)C(Sc1ncccn1)c2ccccc2 62a_100009888967_100000211032 [0,0,0,0,0,1|3,0,0]=4 107 B18R2.4111 CC(=O)N(Cc1ccccc1)c2ccccc2 11a_100000188819_100015343762 [0,0,0,0,0,1|2,0,0]=3 108 B18R2.4111 CC(=O)N(Cc1ccccc1)c2ccccc2 1626a_100000188819_100015343762 [0,0,0,0,0,1|2,0,0]=3 109 B18R2.4111 CC(=O)N(Cc1ccccc1)c2ccccc2 22a_100000188819_100000070787 [0,0,0,0,0,1|2,0,0]=3 110 B18R2.4111 NC(=O)C(Oc1ccccc1)c2ccccc2 7a_100000210340_100000188848 [0,0,0,0,0,1|1,0,0]=2 111 B18R2.4111 NC(=O)C(Oc1cccnc1)c2ccccc2 7a_100000210849_100000188848 [0,0,0,0,0,1|2,0,0]=3 112 B18R2.4111 NC(=O)C(Oc1cncnc1)c2ccccc2 7a_100000754086_100000188848 [0,0,0,0,0,1|3,0,0]=4 113 B18R2.4111 NC(=O)C(Sc1ccccc1)c2ccccc2 62a_100000188848_100000041952 [0,0,0,0,0,1|1,0,0]=2 114 B18R2.4111 NC(=O)C(Sc1ccccc1)c2ccccc2 62a_100000719477_100000188848 [0,0,0,0,0,1|1,0,0]=2 115 B18R2.4111 NC(=O)C(Sc1ccccn1)c2ccccc2 62a_100000188848_100011216584 [0,0,0,0,0,1|2,0,0]=3 116 B18R2.4111 NC(=O)C(Sc1ccccn1)c2ccccc2 62a_100011216584_100000188848 [0,0,0,0,0,1|2,0,0]=3 117 B18R2.4111 NC(=O)C(Sc1cccnc1)c2ccccc2 62a_100000188848_100000210063 [0,0,0,0,0,1|2,0,0]=3 118 B18R2.4111 NC(=O)C(Sc1cccnc1)c2ccccc2 62a_100000210063_100000188848 [0,0,0,0,0,1|2,0,0]=3 119 B18R2.4111 NC(=O)C(Sc1cccnn1)c2ccccc2 62a_100000188848_100016991348 [0,0,0,0,0,1|3,0,0]=4 120 B18R2.4111 NC(=O)C(Sc1cccnn1)c2ccccc2 62a_100016991348_100000188848 [0,0,0,0,0,1|3,0,0]=4 121 B18R2.4111 NC(=O)C(Sc1ccncc1)c2ccccc2 62a_100000188848_100000728582 [0,0,0,0,0,1|2,0,0]=3 122 B18R2.4111 NC(=O)C(Sc1ccncc1)c2ccccc2 62a_100000728582_100000188848 [0,0,0,0,0,1|2,0,0]=3 123 B18R2.4111 NC(=O)C(Sc1ccncn1)c2ccccc2 62a_100000188848_100000703185 [0,0,0,0,0,1|3,0,0]=4 124 B18R2.4111 NC(=O)C(Sc1ccncn1)c2ccccc2 62a_100000703185_100000188848 [0,0,0,0,0,1|3,0,0]=4 125 B18R2.4111 NC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100000188848_100000732662 [0,0,0,0,0,1|3,0,0]=4 126 B18R2.4111 NC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100000732662_100000188848 [0,0,0,0,0,1|3,0,0]=4 127 B18R2.4111 NC(=O)C(Sc1cnccn1)c2ccccc2 62a_100000188848_100000211759 [0,0,0,0,0,1|3,0,0]=4 128 B18R2.4111 NC(=O)C(Sc1cnccn1)c2ccccc2 62a_100000211759_100000188848 [0,0,0,0,0,1|3,0,0]=4 129 B18R2.4111 NC(=O)C(Sc1cncnc1)c2ccccc2 62a_100000188848_100011206942 [0,0,0,0,0,1|3,0,0]=4 130 B18R2.4111 NC(=O)C(Sc1cncnc1)c2ccccc2 62a_100011206942_100000188848 [0,0,0,0,0,1|3,0,0]=4 131 B18R2.4111 NC(=O)C(Sc1ncccn1)c2ccccc2 62a_100000188848_100000211032 [0,0,0,0,0,1|3,0,0]=4 132 B18R2.4111 NC(=O)C(Sc1ncccn1)c2ccccc2 62a_100000211032_100000188848 [0,0,0,0,0,1|3,0,0]=4 133 B18R2.4111 NC(=O)[C@H](Nc1cccnn1)c2ccccc2 27a_100011423151_100016991348 [0,0,0,0,0,1|3,0,0]=4 134 B18R2.4111 NC(=O)[C@H](Nc1ccncn1)c2ccccc2 27a_100011423151_100000703185 [0,0,0,0,0,1|3,0,0]=4 135 B18R2.4111 NC(=O)[C@H](Nc1cnccn1)c2ccccc2 27a_100011423151_100000211759 [0,0,0,0,0,1|3,0,0]=4 136 B18R2.4111 NC(=O)[C@H](Nc1ncccn1)c2ccccc2 27a_100011423151_100000211032 [0,0,0,0,0,1|3,0,0]=4 137 B18R2.4111 [13CH3]C(=O)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_200025704644 [0,0,0,0,0,1|1,0,1]=3 138 B18R2.4111 [13CH3]C(=O)C(Cc1ccccc1)c2ccccc2 1458a_200000261918_200025704644 [0,0,0,0,0,1|1,0,0]=2 139 B18R2.4111 [13CH3]C(=O)C(Sc1ccccc1)c2ccccc2 1458a_100005462441_200025704644 [0,0,0,0,0,1|1,0,0]=2 140 B18R2.7184 CC(=O)C=C(c1ccccc1)c2ccccc2 1458a_200020630570_200000210301 [0,0,0,0,0,1|1,0,1]=3 141 B18R2.7184 CC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200000210301 [0,0,0,0,0,1|1,0,0]=2 142 B18R2.7184 CC(=O)CP(c1ccccc1)c2ccccc2 1458a_200020607205_200000210301 [0,0,0,0,0,1|2,0,0]=3 143 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100015343762 [0,0,0,0,0,1|1,0,0]=2 144 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100015343762 [0,0,0,0,0,1|1,0,0]=2 145 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100015343762 [0,0,0,0,0,1|1,0,0]=2 146 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100103153847 [0,0,0,0,0,1|1,0,0]=2 147 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccn2 11a_100000689936_100015343762 [0,0,0,0,0,1|2,0,0]=3 148 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccn2 1626a_100000689936_100015343762 [0,0,0,0,0,1|2,0,0]=3 149 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100015343762 [0,0,0,0,0,1|2,0,0]=3 150 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccccn2 527a_100000689936_100103153847 [0,0,0,0,0,1|2,0,0]=3 151 B18R2.7184 CC(=O)NC(c1ccccc1)c2cccnc2 11a_100011232609_100015343762 [0,0,0,0,0,1|2,0,0]=3 152 B18R2.7184 CC(=O)NC(c1ccccc1)c2cccnc2 1626a_100011232609_100015343762 [0,0,0,0,0,1|2,0,0]=3 153 B18R2.7184 CC(=O)NC(c1ccccc1)c2cccnc2 240690a_100011232609_100015343762 [0,0,0,0,0,1|2,0,0]=3 154 B18R2.7184 CC(=O)NC(c1ccccc1)c2cccnc2 527a_100011232609_100103153847 [0,0,0,0,0,1|2,0,0]=3 155 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccncc2 11a_100025760769_100015343762 [0,0,0,0,0,1|2,0,0]=3 156 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccncc2 1626a_100025760769_100015343762 [0,0,0,0,0,1|2,0,0]=3 157 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccncc2 240690a_100025760769_100015343762 [0,0,0,0,0,1|2,0,0]=3 158 B18R2.7184 CC(=O)NC(c1ccccc1)c2ccncc2 527a_100025760769_100103153847 [0,0,0,0,0,1|2,0,0]=3 159 B18R2.7184 CC(=O)NC(c1ccccn1)c2ccccn2 11a_100009954364_100015343762 [0,0,0,0,0,1|3,0,0]=4 160 B18R2.7184 CC(=O)NC(c1ccccn1)c2ccccn2 1626a_100009954364_100015343762 [0,0,0,0,0,1|3,0,0]=4 161 B18R2.7184 CC(=O)NC(c1ccccn1)c2ccccn2 240690a_100009954364_100015343762 [0,0,0,0,0,1|3,0,0]=4 162 B18R2.7184 CC(=O)NC(c1ccccn1)c2ccccn2 527a_100009954364_100103153847 [0,0,0,0,0,1|3,0,0]=4 163 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210206 [0,0,0,0,0,1|2,0,1]=4 164 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 2230a_100138425928_100000211591 [0,0,0,0,0,1|2,0,1]=4 165 B18R2.7184 CC(C)NC(c1ccccc1)c2ccccc2 34a_100000162943_100000210206 [0,0,0,0,0,1|2,0,1]=4 166 B18R2.7184 CC(C)OC(c1ccccc1)c2ccccc2 34a_100000211180_100000210206 [0,0,0,0,0,1|2,0,1]=4 167 B18R2.7184 CC(C)OC(c1ccccc1)c2ccccc2 7a_100000211180_100000210206 [0,0,0,0,0,1|2,0,1]=4 168 B18R2.7184 CC(C)SC(c1ccccc1)c2ccccc2 62a_100000210206_100011216954 [0,0,0,0,0,1|2,0,1]=4 169 B18R2.7184 CC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100000210206 [0,0,0,0,0,1|2,0,1]=4 170 B18R2.7184 [13CH3]C(=O)C=C(c1ccccc1)c2ccccc2 1458a_200020630570_200025704644 [0,0,0,0,0,1|1,0,1]=3 171 B18R2.7184 [13CH3]C(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_200025704644 [0,0,0,0,0,1|1,0,0]=2 172 B18R2.7184 [13CH3]C(=O)CP(c1ccccc1)c2ccccc2 1458a_200020607205_200025704644 [0,0,0,0,0,1|2,0,0]=3 173 B15R2.2226 C=C(c1ccccc1)c2ccccc2 271570a_100000068269_100000210277 [2,0,0,0,0,0|0,0,1]=3 174 B15R2.2226 C=C(c1ccccc1)c2ccccn2 271570a_100000068269_100011216584 [2,0,0,0,0,0|1,0,1]=4 175 B15R2.2226 C=C(c1ccccc1)c2cccnc2 271570a_100000068269_100000752921 [2,0,0,0,0,0|1,0,1]=4 176 B15R2.2226 C=C(c1ccccc1)c2ccncc2 271570a_100000068269_100000035832 [2,0,0,0,0,0|1,0,1]=4 177 B17R1.3729 C/C=C/C=CC(=O)C(C(=O)C)c1ccccc1 1458a_100000185730_100009888967 [0,1,1,0,0,0|1,0,1]=4 178 B17R1.3729 C/C=C/C=CC(=O)C(C(=O)N)c1ccccc1 1458a_100000185730_100000188848 [0,1,1,0,0,0|1,0,1]=4 179 B17R1.30518 C=CC=CC(=O)N[C@@H](C(=O)N)c1ccccc1 1626a_100011423151_100016291481 [0,1,1,0,0,0|2,0,0]=4 180 B17R1.9782 C=CC=CC(=O)C(C(=O)OC)c1ccccc1 1458a_100016291481_100000754950 [0,1,1,0,0,0|1,0,0]=3 181 B17R2.159 CCNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000210202 [1,1,0,0,0,0|1,0,1]=4 182 B17R2.159 CCNC(c1ccccc1)c2ccccc2 2230a_100015525214_100000211591 [1,1,0,0,0,0|1,0,1]=4 183 B17R2.159 CCNC(c1ccccc1)c2ccccc2 270004a_100015525214_100000210122 [1,1,0,0,0,0|1,0,1]=4 184 B17R2.159 CCNC(c1ccccc1)c2ccccc2 34a_100000162943_100000210202 [1,1,0,0,0,0|1,0,1]=4 185 B17R2.159 CCOC(c1ccccc1)c2ccccc2 34a_100000211180_100000210202 [1,1,0,0,0,0|1,0,1]=4 186 B17R2.159 CCOC(c1ccccc1)c2ccccc2 7a_100000211180_100000210202 [1,1,0,0,0,0|1,0,1]=4 187 B17R2.159 CCSC(c1ccccc1)c2ccccc2 62a_100000210202_100011216954 [1,1,0,0,0,0|1,0,1]=4 188 B17R2.159 CCSC(c1ccccc1)c2ccccc2 62a_100000211591_100000210202 [1,1,0,0,0,0|1,0,1]=4 189 B17R2.159 CNCC(c1ccccc1)c2ccccc2 2230a_100000739227_200000210301 [1,1,0,0,0,0|1,0,1]=4 190 B17R2.159 CNCC(c1ccccc1)c2ccccc2 34a_100000739227_200000210301 [1,1,0,0,0,0|1,0,1]=4 191 B17R2.159 COCC(c1ccccc1)c2ccccc2 34a_100011215272_200000210301 [1,1,0,0,0,0|0,0,1]=3 192 B17R2.159 COCC(c1ccccc1)c2ccccc2 7a_100011215272_200000210301 [1,1,0,0,0,0|0,0,1]=3 193 B17R2.159 FCNC(c1ccccc1)c2ccccc2 34a_100000162943_100015361967 [1,1,0,0,0,0|1,0,1]=4 194 B17R2.159 FCOC(c1ccccc1)c2ccccc2 34a_100000211180_100015361967 [1,1,0,0,0,0|1,0,1]=4 195 B17R2.159 FCOC(c1ccccc1)c2ccccc2 7a_100000211180_100015361967 [1,1,0,0,0,0|1,0,1]=4 196 B17R2.159 FCSC(c1ccccc1)c2ccccc2 62a_100000211591_100015361967 [1,1,0,0,0,0|1,0,1]=4 197 B17R2.159 FCSC(c1ccccc1)c2ccccc2 62a_100015361967_100011216954 [1,1,0,0,0,0|1,0,1]=4 198 B17R2.159 [13CH3]NCC(c1ccccc1)c2ccccc2 2230a_100000739227_200025704644 [1,1,0,0,0,0|1,0,1]=4 199 B17R2.159 [13CH3]NCC(c1ccccc1)c2ccccc2 34a_100000739227_200025704644 [1,1,0,0,0,0|1,0,1]=4 200 B17R2.159 [13CH3]OCC(c1ccccc1)c2ccccc2 34a_100011215272_200025704644 [1,1,0,0,0,0|0,0,1]=3 201 B17R2.159 [13CH3]OCC(c1ccccc1)c2ccccc2 7a_100011215272_200025704644 [1,1,0,0,0,0|0,0,1]=3 202 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_200000210301 [1,1,0,0,0,0|2,0,0]=4 203 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Br 270004a_106832991635_100011267660 [1,1,0,0,0,0|2,0,0]=4 204 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_200000210301 [1,1,0,0,0,0|2,0,0]=4 205 B17R2.288 CNC(c1ccccc1)c2cccc(c2)C 270004a_106832991635_100011217825 [1,1,0,0,0,0|2,0,0]=4 206 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_200000210301 [1,1,0,0,0,0|2,0,0]=4 207 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Cl 270004a_106832991635_100011215489 [1,1,0,0,0,0|2,0,0]=4 208 B17R2.288 CNC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_200000210301 [1,1,0,0,0,0|2,0,0]=4 209 B17R2.288 CNC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_200000210301 [1,1,0,0,0,0|2,0,0]=4 210 B17R2.288 CNC(c1ccccc1)c2cccc(c2)F 270004a_106832991635_200011219850 [1,1,0,0,0,0|2,0,0]=4 211 B17R2.288 CNC(c1ccccc1)c2cccc(c2)F 34a_100000686443_200000210301 [1,1,0,0,0,0|2,0,0]=4 212 B17R2.288 COC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_200000210301 [1,1,0,0,0,0|2,0,0]=4 213 B17R2.288 COC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_200000210301 [1,1,0,0,0,0|2,0,0]=4 214 B17R2.288 COC(c1ccccc1)c2cccc(c2)F 34a_100000749007_200000210301 [1,1,0,0,0,0|2,0,0]=4 215 B17R2.288 COC(c1ccccc1)c2cccc(c2)F 7a_100000749007_200000210301 [1,1,0,0,0,0|2,0,0]=4 216 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)Br 2230a_100011212009_200025704644 [1,1,0,0,0,0|2,0,0]=4 217 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)Br 34a_100011212009_200025704644 [1,1,0,0,0,0|2,0,0]=4 218 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)Cl 2230a_100000741085_200025704644 [1,1,0,0,0,0|2,0,0]=4 219 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)Cl 34a_100000741085_200025704644 [1,1,0,0,0,0|2,0,0]=4 220 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)F 2230a_100000686443_200025704644 [1,1,0,0,0,0|2,0,0]=4 221 B17R2.288 [13CH3]NC(c1ccccc1)c2cccc(c2)F 34a_100000686443_200025704644 [1,1,0,0,0,0|2,0,0]=4 222 B17R2.288 [13CH3]OC(c1ccccc1)c2cccc(c2)Cl 34a_100000733576_200025704644 [1,1,0,0,0,0|2,0,0]=4 223 B17R2.288 [13CH3]OC(c1ccccc1)c2cccc(c2)Cl 7a_100000733576_200025704644 [1,1,0,0,0,0|2,0,0]=4 224 B17R2.288 [13CH3]OC(c1ccccc1)c2cccc(c2)F 34a_100000749007_200025704644 [1,1,0,0,0,0|2,0,0]=4 225 B17R2.288 [13CH3]OC(c1ccccc1)c2cccc(c2)F 7a_100000749007_200025704644 [1,1,0,0,0,0|2,0,0]=4 226 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_200000210301 [1,1,0,0,0,0|2,0,0]=4 227 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Br 270004a_106832991635_100000718703 [1,1,0,0,0,0|2,0,0]=4 228 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_200000210301 [1,1,0,0,0,0|2,0,0]=4 229 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)C 2230a_100000736602_200000210301 [1,1,0,0,0,0|2,0,0]=4 230 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)C 270004a_106832991635_100000210966 [1,1,0,0,0,0|2,0,0]=4 231 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)C 34a_100000736602_200000210301 [1,1,0,0,0,0|2,0,0]=4 232 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_200000210301 [1,1,0,0,0,0|2,0,0]=4 233 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Cl 2230a_106832991635_100000211669 [1,1,0,0,0,0|2,0,0]=4 234 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Cl 270004a_106832991635_100000211064 [1,1,0,0,0,0|2,0,0]=4 235 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_200000210301 [1,1,0,0,0,0|2,0,0]=4 236 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)Cl 7a_106832991635_100000211669 [1,1,0,0,0,0|2,0,0]=4 237 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_200000210301 [1,1,0,0,0,0|2,0,0]=4 238 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)F 270004a_106832991635_100000210425 [1,1,0,0,0,0|2,0,0]=4 239 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_200000210301 [1,1,0,0,0,0|2,0,0]=4 240 B17R2.291 CNC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_200000210301 [1,1,0,0,0,0|2,0,0]=4 241 B17R2.291 COC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_200000210301 [1,1,0,0,0,0|2,0,0]=4 242 B17R2.291 COC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_200000210301 [1,1,0,0,0,0|2,0,0]=4 243 B17R2.291 COC(c1ccccc1)c2ccc(cc2)C 34a_100000212064_200000210301 [1,1,0,0,0,0|2,0,0]=4 244 B17R2.291 COC(c1ccccc1)c2ccc(cc2)C 7a_100000212064_200000210301 [1,1,0,0,0,0|2,0,0]=4 245 B17R2.291 COC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_200000210301 [1,1,0,0,0,0|2,0,0]=4 246 B17R2.291 COC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_200000210301 [1,1,0,0,0,0|2,0,0]=4 247 B17R2.291 COC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_200000210301 [1,1,0,0,0,0|2,0,0]=4 248 B17R2.291 COC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_200000210301 [1,1,0,0,0,0|2,0,0]=4 249 B17R2.291 COC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_200000210301 [1,1,0,0,0,0|2,0,0]=4 250 B17R2.291 COC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_200000210301 [1,1,0,0,0,0|2,0,0]=4 251 B17R2.291 CSC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_200000210301 [1,1,0,0,0,0|2,0,0]=4 252 B17R2.291 CSC(c1ccccc1)c2ccc(cc2)Cl 62a_200000210301_100000211669 [1,1,0,0,0,0|2,0,0]=4 253 B17R2.291 Cc1ccc(cc1)C(N[13CH3])c2ccccc2 2230a_100000736602_200025704644 [1,1,0,0,0,0|2,0,0]=4 254 B17R2.291 Cc1ccc(cc1)C(N[13CH3])c2ccccc2 34a_100000736602_200025704644 [1,1,0,0,0,0|2,0,0]=4 255 B17R2.291 Cc1ccc(cc1)C(O[13CH3])c2ccccc2 34a_100000212064_200025704644 [1,1,0,0,0,0|2,0,0]=4 256 B17R2.291 Cc1ccc(cc1)C(O[13CH3])c2ccccc2 7a_100000212064_200025704644 [1,1,0,0,0,0|2,0,0]=4 257 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)Br 2230a_100000745999_200025704644 [1,1,0,0,0,0|2,0,0]=4 258 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)Br 34a_100000745999_200025704644 [1,1,0,0,0,0|2,0,0]=4 259 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)Cl 2230a_100000737946_200025704644 [1,1,0,0,0,0|2,0,0]=4 260 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)Cl 34a_100000737946_200025704644 [1,1,0,0,0,0|2,0,0]=4 261 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)F 2230a_100000737529_200025704644 [1,1,0,0,0,0|2,0,0]=4 262 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)F 34a_100000737529_200025704644 [1,1,0,0,0,0|2,0,0]=4 263 B17R2.291 [13CH3]NC(c1ccccc1)c2ccc(cc2)O 34a_100000198503_200025704644 [1,1,0,0,0,0|2,0,0]=4 264 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)Br 34a_100011217567_200025704644 [1,1,0,0,0,0|2,0,0]=4 265 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)Br 7a_100011217567_200025704644 [1,1,0,0,0,0|2,0,0]=4 266 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)Cl 34a_100000211768_200025704644 [1,1,0,0,0,0|2,0,0]=4 267 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)Cl 7a_100000211768_200025704644 [1,1,0,0,0,0|2,0,0]=4 268 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)F 34a_200000246460_200025704644 [1,1,0,0,0,0|2,0,0]=4 269 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)F 7a_200000246460_200025704644 [1,1,0,0,0,0|2,0,0]=4 270 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)N 34a_100011236343_200025704644 [1,1,0,0,0,0|2,0,0]=4 271 B17R2.291 [13CH3]OC(c1ccccc1)c2ccc(cc2)N 7a_100011236343_200025704644 [1,1,0,0,0,0|2,0,0]=4 272 B17R2.291 [13CH3]SC(c1ccccc1)c2ccc(cc2)Cl 62a_100000211669_200025704644 [1,1,0,0,0,0|2,0,0]=4 273 B17R2.291 [13CH3]SC(c1ccccc1)c2ccc(cc2)Cl 62a_200025704644_100000211669 [1,1,0,0,0,0|2,0,0]=4 274 B17R2.2274 CNC(c1ccccc1)c2ccccc2Br 2230a_100011211563_200000210301 [1,1,0,0,0,0|2,0,0]=4 275 B17R2.2274 CNC(c1ccccc1)c2ccccc2Br 270004a_106832991635_100000198044 [1,1,0,0,0,0|2,0,0]=4 276 B17R2.2274 CNC(c1ccccc1)c2ccccc2Br 34a_100011211563_200000210301 [1,1,0,0,0,0|2,0,0]=4 277 B17R2.2274 CNC(c1ccccc1)c2ccccc2C 2230a_100000222801_200000210301 [1,1,0,0,0,0|2,0,0]=4 278 B17R2.2274 CNC(c1ccccc1)c2ccccc2C 2230a_106832991635_100000230135 [1,1,0,0,0,0|2,0,0]=4 279 B17R2.2274 CNC(c1ccccc1)c2ccccc2C 270004a_106832991635_100000735561 [1,1,0,0,0,0|2,0,0]=4 280 B17R2.2274 CNC(c1ccccc1)c2ccccc2C 34a_100000222801_200000210301 [1,1,0,0,0,0|2,0,0]=4 281 B17R2.2274 CNC(c1ccccc1)c2ccccc2C 7a_106832991635_100000230135 [1,1,0,0,0,0|2,0,0]=4 282 B17R2.2274 CNC(c1ccccc1)c2ccccc2Cl 270004a_106832991635_100011215288 [1,1,0,0,0,0|2,0,0]=4 283 B17R2.2274 CNC(c1ccccc1)c2ccccc2F 270004a_106832991635_100011217773 [1,1,0,0,0,0|2,0,0]=4 284 B17R2.2274 COC(c1ccccc1)c2ccccc2C 34a_100000212071_200000210301 [1,1,0,0,0,0|2,0,0]=4 285 B17R2.2274 COC(c1ccccc1)c2ccccc2C 7a_100000212071_200000210301 [1,1,0,0,0,0|2,0,0]=4 286 B17R2.2274 COC(c1ccccc1)c2ccccc2Cl 34a_200011400577_200000210301 [1,1,0,0,0,0|2,0,0]=4 287 B17R2.2274 COC(c1ccccc1)c2ccccc2Cl 7a_200011400577_200000210301 [1,1,0,0,0,0|2,0,0]=4 288 B17R2.2274 COC(c1ccccc1)c2ccccc2N 34a_100000246470_200000210301 [1,1,0,0,0,0|2,0,0]=4 289 B17R2.2274 COC(c1ccccc1)c2ccccc2N 7a_100000246470_200000210301 [1,1,0,0,0,0|2,0,0]=4 290 B17R2.2274 CSC(c1ccccc1)c2ccccc2C 62a_100000230135_200000210301 [1,1,0,0,0,0|2,0,0]=4 291 B17R2.2274 CSC(c1ccccc1)c2ccccc2C 62a_200000210301_100000230135 [1,1,0,0,0,0|2,0,0]=4 292 B17R2.2274 Cc1ccccc1C(N[13CH3])c2ccccc2 2230a_100000222801_200025704644 [1,1,0,0,0,0|2,0,0]=4 293 B17R2.2274 Cc1ccccc1C(N[13CH3])c2ccccc2 34a_100000222801_200025704644 [1,1,0,0,0,0|2,0,0]=4 294 B17R2.2274 Cc1ccccc1C(O[13CH3])c2ccccc2 34a_100000212071_200025704644 [1,1,0,0,0,0|2,0,0]=4 295 B17R2.2274 Cc1ccccc1C(O[13CH3])c2ccccc2 7a_100000212071_200025704644 [1,1,0,0,0,0|2,0,0]=4 296 B17R2.2274 Cc1ccccc1C(S[13CH3])c2ccccc2 62a_100000230135_200025704644 [1,1,0,0,0,0|2,0,0]=4 297 B17R2.2274 Cc1ccccc1C(S[13CH3])c2ccccc2 62a_200025704644_100000230135 [1,1,0,0,0,0|2,0,0]=4 298 B17R2.2274 [13CH3]NC(c1ccccc1)c2ccccc2Br 2230a_100011211563_200025704644 [1,1,0,0,0,0|2,0,0]=4 299 B17R2.2274 [13CH3]NC(c1ccccc1)c2ccccc2Br 34a_100011211563_200025704644 [1,1,0,0,0,0|2,0,0]=4 300 B17R2.2274 [13CH3]OC(c1ccccc1)c2ccccc2Cl 34a_200011400577_200025704644 [1,1,0,0,0,0|2,0,0]=4 301 B17R2.2274 [13CH3]OC(c1ccccc1)c2ccccc2Cl 7a_200011400577_200025704644 [1,1,0,0,0,0|2,0,0]=4 302 B17R2.2274 [13CH3]OC(c1ccccc1)c2ccccc2N 34a_100000246470_200025704644 [1,1,0,0,0,0|2,0,0]=4 303 B17R2.2274 [13CH3]OC(c1ccccc1)c2ccccc2N 7a_100000246470_200025704644 [1,1,0,0,0,0|2,0,0]=4 304 B17R2.2712 CC(O[13CH3])(c1ccccc1)c2ccccc2 7a_100011202337_200025704644 [1,1,0,0,0,0|2,0,0]=4 305 B17R2.2712 COC(C)(c1ccccc1)c2ccccc2 7a_100011202337_200000210301 [1,1,0,0,0,0|2,0,0]=4 306 B19R2.3635 C=CC(=O)N(Cc1ccccc1)c2ccccc2 1626a_100000188819_100000185746 [0,1,0,0,0,1|2,0,0]=4 307 B19R2.3635 C=CC(=O)N(Cc1ccccc1)c2ccccc2 22a_100000188819_100000185746 [0,1,0,0,0,1|2,0,0]=4 308 B19R2.3635 CCC(=O)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_100000210202 [0,1,0,0,0,1|1,0,1]=4 309 B19R2.3635 CCC(=O)C(Cc1ccccc1)c2ccccc2 1458a_200000261918_100000210202 [0,1,0,0,0,1|1,0,0]=3 310 B19R2.3635 CCC(=O)C(Sc1ccccc1)c2ccccc2 1458a_100005462441_100000210202 [0,1,0,0,0,1|1,0,0]=3 311 B19R2.3635 CCC(=O)N(Cc1ccccc1)c2ccccc2 11a_100000188819_100000210414 [0,1,0,0,0,1|2,0,0]=4 312 B19R2.3635 CCC(=O)N(Cc1ccccc1)c2ccccc2 1626a_100000188819_100000210414 [0,1,0,0,0,1|2,0,0]=4 313 B19R2.3635 CCC(=O)N(Cc1ccccc1)c2ccccc2 22a_100000188819_100000210414 [0,1,0,0,0,1|2,0,0]=4 314 B19R2.3635 CNC(=O)/C(=C/c1ccccc1)/c2ccccc2 11a_106832991635_100020600812 [0,1,0,0,0,1|1,0,1]=4 315 B19R2.3635 CNC(=O)C(Cc1ccccc1)c2ccccc2 11a_106832991635_200000261918 [0,1,0,0,0,1|1,0,0]=3 316 B19R2.3635 CNC(=O)C(Cc1ccccc1)c2ccccc2 1626a_100102657272_200000261918 [0,1,0,0,0,1|1,0,0]=3 317 B19R2.3635 CNC(=O)C(Cc1ccccc1)c2ccccc2 240690a_100102657272_200000261918 [0,1,0,0,0,1|1,0,0]=3 318 B19R2.3635 CNC(=O)C(Cc1ccccc1)c2ccccc2 527a_100102657272_200000261918 [0,1,0,0,0,1|1,0,0]=3 319 B19R2.3635 CNC(=O)C(Sc1ccccc1)c2ccccc2 11a_106832991635_100005462441 [0,1,0,0,0,1|1,0,0]=3 320 B19R2.3635 CNC(=O)C(Sc1ccccc1)c2ccccc2 1626a_100102657272_100005462441 [0,1,0,0,0,1|1,0,0]=3 321 B19R2.3635 CNC(=O)C(Sc1ccccc1)c2ccccc2 240690a_100102657272_100005462441 [0,1,0,0,0,1|1,0,0]=3 322 B19R2.3635 CNC(=O)C(Sc1ccccc1)c2ccccc2 527a_100102657272_100005462441 [0,1,0,0,0,1|1,0,0]=3 323 B19R2.3635 COC(=O)C(Nc1ccccc1)c2ccccc2 34a_100000106764_100000185205 [0,1,0,0,0,1|0,0,0]=2 324 B19R2.3635 COC(=O)C(Oc1ccccc1)c2ccccc2 34a_100000210340_100000185205 [0,1,0,0,0,1|0,0,0]=2 325 B19R2.3635 COC(=O)C(Oc1ccccc1)c2ccccc2 7a_100000210340_100000754950 [0,1,0,0,0,1|0,0,0]=2 326 B19R2.3635 COC(=O)C(Oc1cccnc1)c2ccccc2 34a_100000210849_100000185205 [0,1,0,0,0,1|1,0,0]=3 327 B19R2.3635 COC(=O)C(Oc1cccnc1)c2ccccc2 7a_100000210849_100000754950 [0,1,0,0,0,1|1,0,0]=3 328 B19R2.3635 COC(=O)C(Oc1ccncc1)c2ccccc2 34a_100000212176_100000185205 [0,1,0,0,0,1|1,0,0]=3 329 B19R2.3635 COC(=O)C(Oc1ccnnc1)c2ccccc2 34a_100015204005_100000185205 [0,1,0,0,0,1|2,0,0]=4 330 B19R2.3635 COC(=O)C(Oc1cncnc1)c2ccccc2 7a_100000754086_100000754950 [0,1,0,0,0,1|2,0,0]=4 331 B19R2.3635 COC(=O)C(Sc1ccccc1)c2ccccc2 62a_100000719477_100000754950 [0,1,0,0,0,1|0,0,0]=2 332 B19R2.3635 COC(=O)C(Sc1ccccc1)c2ccccc2 62a_100000754950_100000041952 [0,1,0,0,0,1|0,0,0]=2 333 B19R2.3635 COC(=O)C(Sc1ccccn1)c2ccccc2 62a_100000754950_100011216584 [0,1,0,0,0,1|1,0,0]=3 334 B19R2.3635 COC(=O)C(Sc1ccccn1)c2ccccc2 62a_100011216584_100000754950 [0,1,0,0,0,1|1,0,0]=3 335 B19R2.3635 COC(=O)C(Sc1cccnc1)c2ccccc2 62a_100000210063_100000754950 [0,1,0,0,0,1|1,0,0]=3 336 B19R2.3635 COC(=O)C(Sc1cccnc1)c2ccccc2 62a_100000754950_100000210063 [0,1,0,0,0,1|1,0,0]=3 337 B19R2.3635 COC(=O)C(Sc1cccnn1)c2ccccc2 62a_100000754950_100016991348 [0,1,0,0,0,1|2,0,0]=4 338 B19R2.3635 COC(=O)C(Sc1cccnn1)c2ccccc2 62a_100016991348_100000754950 [0,1,0,0,0,1|2,0,0]=4 339 B19R2.3635 COC(=O)C(Sc1ccncc1)c2ccccc2 62a_100000728582_100000754950 [0,1,0,0,0,1|1,0,0]=3 340 B19R2.3635 COC(=O)C(Sc1ccncc1)c2ccccc2 62a_100000754950_100000728582 [0,1,0,0,0,1|1,0,0]=3 341 B19R2.3635 COC(=O)C(Sc1ccncn1)c2ccccc2 62a_100000703185_100000754950 [0,1,0,0,0,1|2,0,0]=4 342 B19R2.3635 COC(=O)C(Sc1ccncn1)c2ccccc2 62a_100000754950_100000703185 [0,1,0,0,0,1|2,0,0]=4 343 B19R2.3635 COC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100000732662_100000754950 [0,1,0,0,0,1|2,0,0]=4 344 B19R2.3635 COC(=O)C(Sc1ccnnc1)c2ccccc2 62a_100000754950_100000732662 [0,1,0,0,0,1|2,0,0]=4 345 B19R2.3635 COC(=O)C(Sc1cnccn1)c2ccccc2 62a_100000211759_100000754950 [0,1,0,0,0,1|2,0,0]=4 346 B19R2.3635 COC(=O)C(Sc1cnccn1)c2ccccc2 62a_100000754950_100000211759 [0,1,0,0,0,1|2,0,0]=4 347 B19R2.3635 COC(=O)C(Sc1cncnc1)c2ccccc2 62a_100000754950_100011206942 [0,1,0,0,0,1|2,0,0]=4 348 B19R2.3635 COC(=O)C(Sc1cncnc1)c2ccccc2 62a_100011206942_100000754950 [0,1,0,0,0,1|2,0,0]=4 349 B19R2.3635 COC(=O)C(Sc1ncccn1)c2ccccc2 62a_100000211032_100000754950 [0,1,0,0,0,1|2,0,0]=4 350 B19R2.3635 COC(=O)C(Sc1ncccn1)c2ccccc2 62a_100000754950_100000211032 [0,1,0,0,0,1|2,0,0]=4 351 B19R2.3635 O=C(CF)/C(=C/c1ccccc1)/c2ccccc2 1458a_100020600812_100015361967 [0,1,0,0,0,1|1,0,1]=4 352 B19R2.3635 O=C(CF)C(Cc1ccccc1)c2ccccc2 1458a_200000261918_100015361967 [0,1,0,0,0,1|1,0,0]=3 353 B19R2.3635 O=C(CF)C(Sc1ccccc1)c2ccccc2 1458a_100005462441_100015361967 [0,1,0,0,0,1|1,0,0]=3 354 B19R2.3635 O=C(CO)N(Cc1ccccc1)c2ccccc2 22a_100000188819_100000210174 [0,1,0,0,0,1|1,0,0]=3 355 B19R2.7173 CC(=O)N(Cc1ccccc1)c2ccccc2C 11a_100102946366_100015343762 [0,1,0,0,0,1|2,0,0]=4 356 B19R2.7173 CC(=O)N(Cc1ccccc1)c2ccccc2C 1626a_100102946366_100015343762 [0,1,0,0,0,1|2,0,0]=4 357 B19R2.7173 CC(=O)N(Cc1ccccc1)c2ccccc2F 11a_100025753533_100015343762 [0,1,0,0,0,1|2,0,0]=4 358 B19R2.7173 CC(=O)N(Cc1ccccc1)c2ccccc2F 1626a_100025753533_100015343762 [0,1,0,0,0,1|2,0,0]=4 359 B19R2.12369 CC(=O)/C(=C/c1ccccc1)/c2ccc(cc2)Cl 1458a_100116280584_200000210301 [0,1,0,0,0,1|1,0,1]=4 360 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)Br 11a_100000187040_100015343762 [0,1,0,0,0,1|2,0,0]=4 361 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)Br 1626a_100000187040_100015343762 [0,1,0,0,0,1|2,0,0]=4 362 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)C 11a_100000185259_100015343762 [0,1,0,0,0,1|2,0,0]=4 363 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)C 1626a_100000185259_100015343762 [0,1,0,0,0,1|2,0,0]=4 364 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)C 22a_100000185259_100000070787 [0,1,0,0,0,1|2,0,0]=4 365 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)Cl 11a_100000187391_100015343762 [0,1,0,0,0,1|2,0,0]=4 366 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)Cl 1626a_100000187391_100015343762 [0,1,0,0,0,1|2,0,0]=4 367 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)O 1626a_200000188756_100015343762 [0,1,0,0,0,1|2,0,0]=4 368 B19R2.12369 CC(=O)N(Cc1ccccc1)c2ccc(cc2)O 22a_200000188756_100000070787 [0,1,0,0,0,1|2,0,0]=4 369 B19R2.12369 [13CH3]C(=O)/C(=C/c1ccccc1)/c2ccc(cc2)Cl 1458a_100116280584_200025704644 [0,1,0,0,0,1|1,0,1]=4 370 B19R2.48169 CC(=O)C(Nc1cccc(c1)C)c2ccccc2 2230a_100000188690_100009888967 [0,1,0,0,0,1|1,0,0]=3 371 B19R2.48169 CC(=O)C(Oc1ccc[n+](c1)[O-])c2ccccc2 7a_100000039713_100009888967 [0,1,0,0,0,1|2,0,0]=4 372 B19R2.48169 CC(=O)C(Oc1cccc(c1)Br)c2ccccc2 7a_100000210342_100009888967 [0,1,0,0,0,1|1,0,0]=3 373 B19R2.48169 CC(=O)C(Oc1cccc(c1)C)c2ccccc2 7a_100000210337_100009888967 [0,1,0,0,0,1|1,0,0]=3 374 B19R2.48169 CC(=O)C(Oc1cccc(c1)Cl)c2ccccc2 7a_100000210295_100009888967 [0,1,0,0,0,1|1,0,0]=3 375 B19R2.48169 CC(=O)C(Oc1cccc(c1)F)c2ccccc2 7a_100000210426_100009888967 [0,1,0,0,0,1|1,0,0]=3 376 B19R2.48169 CC(=O)C(Oc1cccc(c1)I)c2ccccc2 7a_100000211634_100009888967 [0,1,0,0,0,1|1,0,0]=3 377 B19R2.48169 CC(=O)C(Oc1cncc(c1)Br)c2ccccc2 7a_100000754920_100009888967 [0,1,0,0,0,1|2,0,0]=4 378 B19R2.48169 CC(=O)C(Oc1cncc(c1)C)c2ccccc2 7a_100011830280_100009888967 [0,1,0,0,0,1|2,0,0]=4 379 B19R2.48169 CC(=O)C(Oc1cncc(c1)Cl)c2ccccc2 7a_100000032511_100009888967 [0,1,0,0,0,1|2,0,0]=4 380 B19R2.48169 CC(=O)C(Oc1cncc(c1)F)c2ccccc2 7a_100011830296_100009888967 [0,1,0,0,0,1|2,0,0]=4 381 B19R2.48169 CC(=O)C(Sc1cc(=O)cc[nH]1)c2ccccc2 62a_100009817434_100009888967 [0,1,0,0,0,1|2,0,0]=4 382 B19R2.48169 CC(=O)C(Sc1cc(ccn1)C)c2ccccc2 62a_100000750283_100009888967 [0,1,0,0,0,1|2,0,0]=4 383 B19R2.48169 CC(=O)C(Sc1cc(ccn1)C)c2ccccc2 62a_100009888967_100000750283 [0,1,0,0,0,1|2,0,0]=4 384 B19R2.48169 CC(=O)C(Sc1cc(ccn1)Cl)c2ccccc2 62a_100009888967_100010167805 [0,1,0,0,0,1|2,0,0]=4 385 B19R2.48169 CC(=O)C(Sc1cc(ccn1)Cl)c2ccccc2 62a_100010167805_100009888967 [0,1,0,0,0,1|2,0,0]=4 386 B19R2.48169 CC(=O)C(Sc1cc(ccn1)F)c2ccccc2 62a_100000764206_100009888967 [0,1,0,0,0,1|2,0,0]=4 387 B19R2.48169 CC(=O)C(Sc1cc(ccn1)F)c2ccccc2 62a_100009888967_100000764206 [0,1,0,0,0,1|2,0,0]=4 388 B19R2.48169 CC(=O)C(Sc1cc(ccn1)N)c2ccccc2 62a_100009814236_100009888967 [0,1,0,0,0,1|2,0,0]=4 389 B19R2.48169 CC(=O)C(Sc1cc(ccn1)N)c2ccccc2 62a_100009888967_100009814236 [0,1,0,0,0,1|2,0,0]=4 390 B19R2.48169 CC(=O)C(Sc1cc(ccn1)O)c2ccccc2 62a_100009888967_100000762945 [0,1,0,0,0,1|2,0,0]=4 391 B19R2.48169 CC(=O)C(Sc1cc[nH]c(=O)c1)c2ccccc2 62a_100009816521_100009888967 [0,1,0,0,0,1|2,0,0]=4 392 B19R2.48169 CC(=O)C(Sc1cc[nH]c(=O)c1)c2ccccc2 62a_100009888967_100009816521 [0,1,0,0,0,1|2,0,0]=4 393 B19R2.48169 CC(=O)C(Sc1ccc[n+](c1)C)c2ccccc2 62a_100009888967_100009996589 [0,1,0,0,0,1|2,0,0]=4 394 B19R2.48169 CC(=O)C(Sc1ccc[n+](c1)C)c2ccccc2 62a_100009996589_100009888967 [0,1,0,0,0,1|2,0,0]=4 395 B19R2.48169 CC(=O)C(Sc1ccc[n+](c1)[O-])c2ccccc2 62a_100009888967_100009815978 [0,1,0,0,0,1|2,0,0]=4 396 B19R2.48169 CC(=O)C(Sc1cccc(=O)[nH]1)c2ccccc2 62a_100009888967_100000752884 [0,1,0,0,0,1|2,0,0]=4 397 B19R2.48169 CC(=O)C(Sc1cccc(c1)Br)c2ccccc2 62a_100000691529_100009888967 [0,1,0,0,0,1|1,0,0]=3 398 B19R2.48169 CC(=O)C(Sc1cccc(c1)Br)c2ccccc2 62a_100009888967_100000691529 [0,1,0,0,0,1|1,0,0]=3 399 B19R2.48169 CC(=O)C(Sc1cccc(c1)C)c2ccccc2 62a_100009888967_100011215228 [0,1,0,0,0,1|1,0,0]=3 400 B19R2.48169 CC(=O)C(Sc1cccc(c1)C)c2ccccc2 62a_100011215228_100009888967 [0,1,0,0,0,1|1,0,0]=3 401 B19R2.48169 CC(=O)C(Sc1cccc(c1)Cl)c2ccccc2 62a_100000699651_100009888967 [0,1,0,0,0,1|1,0,0]=3 402 B19R2.48169 CC(=O)C(Sc1cccc(c1)Cl)c2ccccc2 62a_100009888967_100000699651 [0,1,0,0,0,1|1,0,0]=3 403 B19R2.48169 CC(=O)C(Sc1cccc(c1)F)c2ccccc2 62a_100000685547_100009888967 [0,1,0,0,0,1|1,0,0]=3 404 B19R2.48169 CC(=O)C(Sc1cccc(c1)F)c2ccccc2 62a_100009888967_100000685547 [0,1,0,0,0,1|1,0,0]=3 405 B19R2.48169 CC(=O)C(Sc1cccc(c1)N)c2ccccc2 62a_100000210019_100009888967 [0,1,0,0,0,1|1,0,0]=3 406 B19R2.48169 CC(=O)C(Sc1cccc(c1)N)c2ccccc2 62a_100009888967_100000210019 [0,1,0,0,0,1|1,0,0]=3 407 B19R2.48169 CC(=O)C(Sc1cccc(c1)O)c2ccccc2 62a_100009888967_100000211634 [0,1,0,0,0,1|1,0,0]=3 408 B19R2.48169 CC(=O)C(Sc1cccc(c1)[S])c2ccccc2 62a_100009888967_114929384022 [0,1,0,0,0,1|1,0,0]=3 409 B19R2.48169 CC(=O)C(Sc1cccc(c1)[S])c2ccccc2 62a_114929384022_100009888967 [0,1,0,0,0,1|1,0,0]=3 410 B19R2.48169 CC(=O)C(Sc1cccc(n1)Br)c2ccccc2 62a_100000684672_100009888967 [0,1,0,0,0,1|2,0,0]=4 411 B19R2.48169 CC(=O)C(Sc1cccc(n1)Br)c2ccccc2 62a_100009888967_100000684672 [0,1,0,0,0,1|2,0,0]=4 412 B19R2.48169 CC(=O)C(Sc1cccc(n1)C)c2ccccc2 62a_100000742759_100009888967 [0,1,0,0,0,1|2,0,0]=4 413 B19R2.48169 CC(=O)C(Sc1cccc(n1)C)c2ccccc2 62a_100009888967_100000742759 [0,1,0,0,0,1|2,0,0]=4 414 B19R2.48169 CC(=O)C(Sc1cccc(n1)Cl)c2ccccc2 62a_100000051397_100009888967 [0,1,0,0,0,1|2,0,0]=4 415 B19R2.48169 CC(=O)C(Sc1cccc(n1)Cl)c2ccccc2 62a_100009888967_100000051397 [0,1,0,0,0,1|2,0,0]=4 416 B19R2.48169 CC(=O)C(Sc1cccc(n1)F)c2ccccc2 62a_100009815982_100009888967 [0,1,0,0,0,1|2,0,0]=4 417 B19R2.48169 CC(=O)C(Sc1cccc(n1)F)c2ccccc2 62a_100009888967_100009815982 [0,1,0,0,0,1|2,0,0]=4 418 B19R2.48169 CC(=O)C(Sc1cccc(n1)N)c2ccccc2 62a_100000740741_100009888967 [0,1,0,0,0,1|2,0,0]=4 419 B19R2.48169 CC(=O)C(Sc1cccc(n1)N)c2ccccc2 62a_100009888967_100000740741 [0,1,0,0,0,1|2,0,0]=4 420 B19R2.48169 CC(=O)C(Sc1ccnc(c1)Br)c2ccccc2 62a_100009814637_100009888967 [0,1,0,0,0,1|2,0,0]=4 421 B19R2.48169 CC(=O)C(Sc1ccnc(c1)Br)c2ccccc2 62a_100009888967_100009814637 [0,1,0,0,0,1|2,0,0]=4 422 B19R2.48169 CC(=O)C(Sc1ccnc(c1)C)c2ccccc2 62a_100000758586_100009888967 [0,1,0,0,0,1|2,0,0]=4 423 B19R2.48169 CC(=O)C(Sc1ccnc(c1)C)c2ccccc2 62a_100009888967_100000758586 [0,1,0,0,0,1|2,0,0]=4 424 B19R2.48169 CC(=O)C(Sc1ccnc(c1)Cl)c2ccccc2 62a_100000035001_100009888967 [0,1,0,0,0,1|2,0,0]=4 425 B19R2.48169 CC(=O)C(Sc1ccnc(c1)Cl)c2ccccc2 62a_100009888967_100000035001 [0,1,0,0,0,1|2,0,0]=4 426 B19R2.48169 CC(=O)C(Sc1ccnc(c1)F)c2ccccc2 62a_100009816116_100009888967 [0,1,0,0,0,1|2,0,0]=4 427 B19R2.48169 CC(=O)C(Sc1ccnc(c1)F)c2ccccc2 62a_100009888967_100009816116 [0,1,0,0,0,1|2,0,0]=4 428 B19R2.48169 CC(=O)C(Sc1ccnc(c1)N)c2ccccc2 62a_100000049665_100009888967 [0,1,0,0,0,1|2,0,0]=4 429 B19R2.48169 CC(=O)C(Sc1ccnc(c1)N)c2ccccc2 62a_100009888967_100000049665 [0,1,0,0,0,1|2,0,0]=4 430 B19R2.48169 CC(=O)C(Sc1cncc(c1)Br)c2ccccc2 62a_100000728054_100009888967 [0,1,0,0,0,1|2,0,0]=4 431 B19R2.48169 CC(=O)C(Sc1cncc(c1)Br)c2ccccc2 62a_100009888967_100000728054 [0,1,0,0,0,1|2,0,0]=4 432 B19R2.48169 CC(=O)C(Sc1cncc(c1)C)c2ccccc2 62a_100000760492_100009888967 [0,1,0,0,0,1|2,0,0]=4 433 B19R2.48169 CC(=O)C(Sc1cncc(c1)C)c2ccccc2 62a_100009888967_100000760492 [0,1,0,0,0,1|2,0,0]=4 434 B19R2.48169 CC(=O)C(Sc1cncc(c1)Cl)c2ccccc2 62a_100000049639_100009888967 [0,1,0,0,0,1|2,0,0]=4 435 B19R2.48169 CC(=O)C(Sc1cncc(c1)Cl)c2ccccc2 62a_100009888967_100000049639 [0,1,0,0,0,1|2,0,0]=4 436 B19R2.48169 CC(=O)C(Sc1cncc(c1)F)c2ccccc2 62a_100000744099_100009888967 [0,1,0,0,0,1|2,0,0]=4 437 B19R2.48169 CC(=O)C(Sc1cncc(c1)F)c2ccccc2 62a_100009888967_100000744099 [0,1,0,0,0,1|2,0,0]=4 438 B19R2.48169 CC(=O)C(Sc1cncc(c1)N)c2ccccc2 62a_100000687067_100009888967 [0,1,0,0,0,1|2,0,0]=4 439 B19R2.48169 CC(=O)C(Sc1cncc(c1)N)c2ccccc2 62a_100009888967_100000687067 [0,1,0,0,0,1|2,0,0]=4 440 B19R2.48169 CC(=O)C(Sc1cncc(c1)O)c2ccccc2 62a_100000754920_100009888967 [0,1,0,0,0,1|2,0,0]=4 441 B19R2.48169 CC(=O)C(Sc1cncc(c1)O)c2ccccc2 62a_100009888967_100000754920 [0,1,0,0,0,1|2,0,0]=4 442 B19R2.48169 C[n+]1cccc(c1)SC(C(=O)N)c2ccccc2 62a_100000188848_100009996589 [0,1,0,0,0,1|2,0,0]=4 443 B19R2.48169 C[n+]1cccc(c1)SC(C(=O)N)c2ccccc2 62a_100009996589_100000188848 [0,1,0,0,0,1|2,0,0]=4 444 B19R2.48169 Cc1cc(ccn1)N[C@@H](C(=O)N)c2ccccc2 27a_100011423151_100000758586 [0,1,0,0,0,1|2,0,0]=4 445 B19R2.48169 Cc1cc(ccn1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000758586 [0,1,0,0,0,1|2,0,0]=4 446 B19R2.48169 Cc1cc(ccn1)SC(C(=O)N)c2ccccc2 62a_100000758586_100000188848 [0,1,0,0,0,1|2,0,0]=4 447 B19R2.48169 Cc1cccc(c1)NC(C(=O)N)c2ccccc2 2230a_100000188690_100000188848 [0,1,0,0,0,1|1,0,0]=3 448 B19R2.48169 Cc1cccc(c1)OC(C(=O)N)c2ccccc2 7a_100000210337_100000188848 [0,1,0,0,0,1|1,0,0]=3 449 B19R2.48169 Cc1cccc(c1)SC(C(=O)N)c2ccccc2 62a_100000188848_100011215228 [0,1,0,0,0,1|1,0,0]=3 450 B19R2.48169 Cc1cccc(c1)SC(C(=O)N)c2ccccc2 62a_100011215228_100000188848 [0,1,0,0,0,1|1,0,0]=3 451 B19R2.48169 Cc1cccc(n1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000742759 [0,1,0,0,0,1|2,0,0]=4 452 B19R2.48169 Cc1cccc(n1)SC(C(=O)N)c2ccccc2 62a_100000742759_100000188848 [0,1,0,0,0,1|2,0,0]=4 453 B19R2.48169 Cc1ccnc(c1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000750283 [0,1,0,0,0,1|2,0,0]=4 454 B19R2.48169 Cc1ccnc(c1)SC(C(=O)N)c2ccccc2 62a_100000750283_100000188848 [0,1,0,0,0,1|2,0,0]=4 455 B19R2.48169 Cc1cncc(c1)OC(C(=O)N)c2ccccc2 7a_100011830280_100000188848 [0,1,0,0,0,1|2,0,0]=4 456 B19R2.48169 Cc1cncc(c1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000760492 [0,1,0,0,0,1|2,0,0]=4 457 B19R2.48169 Cc1cncc(c1)SC(C(=O)N)c2ccccc2 62a_100000760492_100000188848 [0,1,0,0,0,1|2,0,0]=4 458 B19R2.48169 NC(=O)C(Oc1ccc[n+](c1)[O-])c2ccccc2 7a_100000039713_100000188848 [0,1,0,0,0,1|2,0,0]=4 459 B19R2.48169 NC(=O)C(Oc1cccc(c1)Br)c2ccccc2 7a_100000210342_100000188848 [0,1,0,0,0,1|1,0,0]=3 460 B19R2.48169 NC(=O)C(Oc1cccc(c1)Cl)c2ccccc2 7a_100000210295_100000188848 [0,1,0,0,0,1|1,0,0]=3 461 B19R2.48169 NC(=O)C(Oc1cccc(c1)F)c2ccccc2 7a_100000210426_100000188848 [0,1,0,0,0,1|1,0,0]=3 462 B19R2.48169 NC(=O)C(Oc1cccc(c1)I)c2ccccc2 7a_100000211634_100000188848 [0,1,0,0,0,1|1,0,0]=3 463 B19R2.48169 NC(=O)C(Oc1cncc(c1)Br)c2ccccc2 7a_100000754920_100000188848 [0,1,0,0,0,1|2,0,0]=4 464 B19R2.48169 NC(=O)C(Oc1cncc(c1)Cl)c2ccccc2 7a_100000032511_100000188848 [0,1,0,0,0,1|2,0,0]=4 465 B19R2.48169 NC(=O)C(Oc1cncc(c1)F)c2ccccc2 7a_100011830296_100000188848 [0,1,0,0,0,1|2,0,0]=4 466 B19R2.48169 NC(=O)C(Sc1cc(=O)cc[nH]1)c2ccccc2 62a_100009817434_100000188848 [0,1,0,0,0,1|2,0,0]=4 467 B19R2.48169 NC(=O)C(Sc1cc(ccn1)Cl)c2ccccc2 62a_100000188848_100010167805 [0,1,0,0,0,1|2,0,0]=4 468 B19R2.48169 NC(=O)C(Sc1cc(ccn1)Cl)c2ccccc2 62a_100010167805_100000188848 [0,1,0,0,0,1|2,0,0]=4 469 B19R2.48169 NC(=O)C(Sc1cc(ccn1)F)c2ccccc2 62a_100000188848_100000764206 [0,1,0,0,0,1|2,0,0]=4 470 B19R2.48169 NC(=O)C(Sc1cc(ccn1)F)c2ccccc2 62a_100000764206_100000188848 [0,1,0,0,0,1|2,0,0]=4 471 B19R2.48169 NC(=O)C(Sc1cc(ccn1)N)c2ccccc2 62a_100000188848_100009814236 [0,1,0,0,0,1|2,0,0]=4 472 B19R2.48169 NC(=O)C(Sc1cc(ccn1)N)c2ccccc2 62a_100009814236_100000188848 [0,1,0,0,0,1|2,0,0]=4 473 B19R2.48169 NC(=O)C(Sc1cc(ccn1)O)c2ccccc2 62a_100000188848_100000762945 [0,1,0,0,0,1|2,0,0]=4 474 B19R2.48169 NC(=O)C(Sc1cc[nH]c(=O)c1)c2ccccc2 62a_100000188848_100009816521 [0,1,0,0,0,1|2,0,0]=4 475 B19R2.48169 NC(=O)C(Sc1cc[nH]c(=O)c1)c2ccccc2 62a_100009816521_100000188848 [0,1,0,0,0,1|2,0,0]=4 476 B19R2.48169 NC(=O)C(Sc1ccc[n+](c1)[O-])c2ccccc2 62a_100000188848_100009815978 [0,1,0,0,0,1|2,0,0]=4 477 B19R2.48169 NC(=O)C(Sc1cccc(=O)[nH]1)c2ccccc2 62a_100000188848_100000752884 [0,1,0,0,0,1|2,0,0]=4 478 B19R2.48169 NC(=O)C(Sc1cccc(c1)Br)c2ccccc2 62a_100000188848_100000691529 [0,1,0,0,0,1|1,0,0]=3 479 B19R2.48169 NC(=O)C(Sc1cccc(c1)Br)c2ccccc2 62a_100000691529_100000188848 [0,1,0,0,0,1|1,0,0]=3 480 B19R2.48169 NC(=O)C(Sc1cccc(c1)Cl)c2ccccc2 62a_100000188848_100000699651 [0,1,0,0,0,1|1,0,0]=3 481 B19R2.48169 NC(=O)C(Sc1cccc(c1)Cl)c2ccccc2 62a_100000699651_100000188848 [0,1,0,0,0,1|1,0,0]=3 482 B19R2.48169 NC(=O)C(Sc1cccc(c1)F)c2ccccc2 62a_100000188848_100000685547 [0,1,0,0,0,1|1,0,0]=3 483 B19R2.48169 NC(=O)C(Sc1cccc(c1)F)c2ccccc2 62a_100000685547_100000188848 [0,1,0,0,0,1|1,0,0]=3 484 B19R2.48169 NC(=O)C(Sc1cccc(c1)N)c2ccccc2 62a_100000188848_100000210019 [0,1,0,0,0,1|1,0,0]=3 485 B19R2.48169 NC(=O)C(Sc1cccc(c1)N)c2ccccc2 62a_100000210019_100000188848 [0,1,0,0,0,1|1,0,0]=3 486 B19R2.48169 NC(=O)C(Sc1cccc(c1)O)c2ccccc2 62a_100000188848_100000211634 [0,1,0,0,0,1|1,0,0]=3 487 B19R2.48169 NC(=O)C(Sc1cccc(c1)[S])c2ccccc2 62a_100000188848_114929384022 [0,1,0,0,0,1|1,0,0]=3 488 B19R2.48169 NC(=O)C(Sc1cccc(c1)[S])c2ccccc2 62a_114929384022_100000188848 [0,1,0,0,0,1|1,0,0]=3 489 B19R2.48169 NC(=O)C(Sc1cccc(n1)Br)c2ccccc2 62a_100000188848_100000684672 [0,1,0,0,0,1|2,0,0]=4 490 B19R2.48169 NC(=O)C(Sc1cccc(n1)Br)c2ccccc2 62a_100000684672_100000188848 [0,1,0,0,0,1|2,0,0]=4 491 B19R2.48169 NC(=O)C(Sc1cccc(n1)Cl)c2ccccc2 62a_100000051397_100000188848 [0,1,0,0,0,1|2,0,0]=4 492 B19R2.48169 NC(=O)C(Sc1cccc(n1)Cl)c2ccccc2 62a_100000188848_100000051397 [0,1,0,0,0,1|2,0,0]=4 493 B19R2.48169 NC(=O)C(Sc1cccc(n1)F)c2ccccc2 62a_100000188848_100009815982 [0,1,0,0,0,1|2,0,0]=4 494 B19R2.48169 NC(=O)C(Sc1cccc(n1)F)c2ccccc2 62a_100009815982_100000188848 [0,1,0,0,0,1|2,0,0]=4 495 B19R2.48169 NC(=O)C(Sc1cccc(n1)N)c2ccccc2 62a_100000188848_100000740741 [0,1,0,0,0,1|2,0,0]=4 496 B19R2.48169 NC(=O)C(Sc1cccc(n1)N)c2ccccc2 62a_100000740741_100000188848 [0,1,0,0,0,1|2,0,0]=4 497 B19R2.48169 NC(=O)C(Sc1ccnc(c1)Br)c2ccccc2 62a_100000188848_100009814637 [0,1,0,0,0,1|2,0,0]=4 498 B19R2.48169 NC(=O)C(Sc1ccnc(c1)Br)c2ccccc2 62a_100009814637_100000188848 [0,1,0,0,0,1|2,0,0]=4 499 B19R2.48169 NC(=O)C(Sc1ccnc(c1)Cl)c2ccccc2 62a_100000035001_100000188848 [0,1,0,0,0,1|2,0,0]=4 500 B19R2.48169 NC(=O)C(Sc1ccnc(c1)Cl)c2ccccc2 62a_100000188848_100000035001 [0,1,0,0,0,1|2,0,0]=4 501 B19R2.48169 NC(=O)C(Sc1ccnc(c1)F)c2ccccc2 62a_100000188848_100009816116 [0,1,0,0,0,1|2,0,0]=4 502 B19R2.48169 NC(=O)C(Sc1ccnc(c1)F)c2ccccc2 62a_100009816116_100000188848 [0,1,0,0,0,1|2,0,0]=4 503 B19R2.48169 NC(=O)C(Sc1ccnc(c1)N)c2ccccc2 62a_100000049665_100000188848 [0,1,0,0,0,1|2,0,0]=4 504 B19R2.48169 NC(=O)C(Sc1ccnc(c1)N)c2ccccc2 62a_100000188848_100000049665 [0,1,0,0,0,1|2,0,0]=4 505 B19R2.48169 NC(=O)C(Sc1cncc(c1)Br)c2ccccc2 62a_100000188848_100000728054 [0,1,0,0,0,1|2,0,0]=4 506 B19R2.48169 NC(=O)C(Sc1cncc(c1)Br)c2ccccc2 62a_100000728054_100000188848 [0,1,0,0,0,1|2,0,0]=4 507 B19R2.48169 NC(=O)C(Sc1cncc(c1)Cl)c2ccccc2 62a_100000049639_100000188848 [0,1,0,0,0,1|2,0,0]=4 508 B19R2.48169 NC(=O)C(Sc1cncc(c1)Cl)c2ccccc2 62a_100000188848_100000049639 [0,1,0,0,0,1|2,0,0]=4 509 B19R2.48169 NC(=O)C(Sc1cncc(c1)F)c2ccccc2 62a_100000188848_100000744099 [0,1,0,0,0,1|2,0,0]=4 510 B19R2.48169 NC(=O)C(Sc1cncc(c1)F)c2ccccc2 62a_100000744099_100000188848 [0,1,0,0,0,1|2,0,0]=4 511 B19R2.48169 NC(=O)C(Sc1cncc(c1)N)c2ccccc2 62a_100000188848_100000687067 [0,1,0,0,0,1|2,0,0]=4 512 B19R2.48169 NC(=O)C(Sc1cncc(c1)N)c2ccccc2 62a_100000687067_100000188848 [0,1,0,0,0,1|2,0,0]=4 513 B19R2.48169 NC(=O)C(Sc1cncc(c1)O)c2ccccc2 62a_100000188848_100000754920 [0,1,0,0,0,1|2,0,0]=4 514 B19R2.48169 NC(=O)C(Sc1cncc(c1)O)c2ccccc2 62a_100000754920_100000188848 [0,1,0,0,0,1|2,0,0]=4 515 B19R2.48169 NC(=O)[C@H](Nc1cc(ccn1)F)c2ccccc2 27a_100011423151_100000764206 [0,1,0,0,0,1|2,0,0]=4 516 B19R2.48169 NC(=O)[C@H](Nc1cc[nH]c(=O)c1)c2ccccc2 27a_100011423151_100000061649 [0,1,0,0,0,1|2,0,0]=4 517 B19R2.48169 NC(=O)[C@H](Nc1cccc(n1)F)c2ccccc2 27a_100011423151_100009815982 [0,1,0,0,0,1|2,0,0]=4 518 B19R2.48169 NC(=O)[C@H](Nc1ccnc(c1)F)c2ccccc2 27a_100011423151_100009816116 [0,1,0,0,0,1|2,0,0]=4 519 B19R2.97861 CC(=O)C(Oc1cccc[n+]1[O-])c2ccccc2 7a_100000211761_100009888967 [0,1,0,0,0,1|2,0,0]=4 520 B19R2.97861 CC(=O)C(Oc1ccccc1Br)c2ccccc2 7a_100000181306_100009888967 [0,1,0,0,0,1|1,0,0]=3 521 B19R2.97861 CC(=O)C(Oc1ccccc1C)c2ccccc2 7a_100000210338_100009888967 [0,1,0,0,0,1|1,0,0]=3 522 B19R2.97861 CC(=O)C(Oc1ccccc1Cl)c2ccccc2 7a_100000210172_100009888967 [0,1,0,0,0,1|1,0,0]=3 523 B19R2.97861 CC(=O)C(Oc1ccccc1F)c2ccccc2 7a_100000210171_100009888967 [0,1,0,0,0,1|1,0,0]=3 524 B19R2.97861 CC(=O)C(Oc1ccccc1I)c2ccccc2 7a_100000739446_100009888967 [0,1,0,0,0,1|1,0,0]=3 525 B19R2.97861 CC(=O)C(Oc1ccccc1N)c2ccccc2 7a_100000185747_100009888967 [0,1,0,0,0,1|1,0,0]=3 526 B19R2.97861 CC(=O)C(Oc1cccnc1Br)c2ccccc2 7a_100000744436_100009888967 [0,1,0,0,0,1|2,0,0]=4 527 B19R2.97861 CC(=O)C(Oc1cccnc1C)c2ccccc2 7a_100000745507_100009888967 [0,1,0,0,0,1|2,0,0]=4 528 B19R2.97861 CC(=O)C(Oc1cccnc1Cl)c2ccccc2 7a_100000757616_100009888967 [0,1,0,0,0,1|2,0,0]=4 529 B19R2.97861 CC(=O)C(Oc1cccnc1F)c2ccccc2 7a_100000061740_100009888967 [0,1,0,0,0,1|2,0,0]=4 530 B19R2.97861 CC(=O)C(Oc1cccnc1I)c2ccccc2 7a_100000034122_100009888967 [0,1,0,0,0,1|2,0,0]=4 531 B19R2.97861 CC(=O)C(Oc1cccnc1N)c2ccccc2 7a_100000211975_100009888967 [0,1,0,0,0,1|2,0,0]=4 532 B19R2.97861 CC(=O)C(Oc1cccoc1=O)c2ccccc2 7a_100000077404_100009888967 [0,1,0,0,0,1|2,0,0]=4 533 B19R2.97861 CC(=O)C(Oc1cnccc1C)c2ccccc2 7a_100011997053_100009888967 [0,1,0,0,0,1|2,0,0]=4 534 B19R2.97861 CC(=O)C(Sc1c[nH]ccc1=O)c2ccccc2 62a_100009888967_100009998708 [0,1,0,0,0,1|2,0,0]=4 535 B19R2.97861 CC(=O)C(Sc1c[nH]ccc1=O)c2ccccc2 62a_100009998708_100009888967 [0,1,0,0,0,1|2,0,0]=4 536 B19R2.97861 CC(=O)C(Sc1c[nH]ccc1=S)c2ccccc2 62a_100009888967_200012280681 [0,1,0,0,0,1|2,0,0]=4 537 B19R2.97861 CC(=O)C(Sc1c[nH]ccc1=S)c2ccccc2 62a_200012280681_100009888967 [0,1,0,0,0,1|2,0,0]=4 538 B19R2.97861 CC(=O)C(Sc1cccc[n+]1C)c2ccccc2 62a_100009888967_100000212160 [0,1,0,0,0,1|2,0,0]=4 539 B19R2.97861 CC(=O)C(Sc1cccc[n+]1[O-])c2ccccc2 62a_100009888967_200000042595 [0,1,0,0,0,1|2,0,0]=4 540 B19R2.97861 CC(=O)C(Sc1ccccc1Br)c2ccccc2 62a_100000695589_100009888967 [0,1,0,0,0,1|1,0,0]=3 541 B19R2.97861 CC(=O)C(Sc1ccccc1Br)c2ccccc2 62a_100009888967_100000695589 [0,1,0,0,0,1|1,0,0]=3 542 B19R2.97861 CC(=O)C(Sc1ccccc1C)c2ccccc2 62a_100000210755_100009888967 [0,1,0,0,0,1|1,0,0]=3 543 B19R2.97861 CC(=O)C(Sc1ccccc1C)c2ccccc2 62a_100009888967_100000210755 [0,1,0,0,0,1|1,0,0]=3 544 B19R2.97861 CC(=O)C(Sc1ccccc1Cl)c2ccccc2 62a_100000764095_100009888967 [0,1,0,0,0,1|1,0,0]=3 545 B19R2.97861 CC(=O)C(Sc1ccccc1Cl)c2ccccc2 62a_100009888967_100000764095 [0,1,0,0,0,1|1,0,0]=3 546 B19R2.97861 CC(=O)C(Sc1ccccc1F)c2ccccc2 1458a_100000594731_200000210301 [0,1,0,0,0,1|1,0,0]=3 547 B19R2.97861 CC(=O)C(Sc1ccccc1F)c2ccccc2 62a_100009888967_100011215700 [0,1,0,0,0,1|1,0,0]=3 548 B19R2.97861 CC(=O)C(Sc1ccccc1F)c2ccccc2 62a_100011215700_100009888967 [0,1,0,0,0,1|1,0,0]=3 549 B19R2.97861 CC(=O)C(Sc1ccccc1N)c2ccccc2 62a_100000210017_100009888967 [0,1,0,0,0,1|1,0,0]=3 550 B19R2.97861 CC(=O)C(Sc1ccccc1N)c2ccccc2 62a_100009888967_100000210017 [0,1,0,0,0,1|1,0,0]=3 551 B19R2.97861 CC(=O)C(Sc1ccccc1O)c2ccccc2 62a_100000739446_100009888967 [0,1,0,0,0,1|1,0,0]=3 552 B19R2.97861 CC(=O)C(Sc1ccccc1O)c2ccccc2 62a_100009888967_100000739446 [0,1,0,0,0,1|1,0,0]=3 553 B19R2.97861 CC(=O)C(Sc1cccnc1Br)c2ccccc2 62a_100009888967_100010202626 [0,1,0,0,0,1|2,0,0]=4 554 B19R2.97861 CC(=O)C(Sc1cccnc1Br)c2ccccc2 62a_100010202626_100009888967 [0,1,0,0,0,1|2,0,0]=4 555 B19R2.97861 CC(=O)C(Sc1cccnc1C)c2ccccc2 62a_100000751574_100009888967 [0,1,0,0,0,1|2,0,0]=4 556 B19R2.97861 CC(=O)C(Sc1cccnc1C)c2ccccc2 62a_100009888967_100000751574 [0,1,0,0,0,1|2,0,0]=4 557 B19R2.97861 CC(=O)C(Sc1cccnc1Cl)c2ccccc2 62a_100000036424_100009888967 [0,1,0,0,0,1|2,0,0]=4 558 B19R2.97861 CC(=O)C(Sc1cccnc1Cl)c2ccccc2 62a_100009888967_100000036424 [0,1,0,0,0,1|2,0,0]=4 559 B19R2.97861 CC(=O)C(Sc1cccnc1F)c2ccccc2 62a_100009816115_100009888967 [0,1,0,0,0,1|2,0,0]=4 560 B19R2.97861 CC(=O)C(Sc1cccnc1F)c2ccccc2 62a_100009888967_100009816115 [0,1,0,0,0,1|2,0,0]=4 561 B19R2.97861 CC(=O)C(Sc1cccnc1N)c2ccccc2 62a_100000045569_100009888967 [0,1,0,0,0,1|2,0,0]=4 562 B19R2.97861 CC(=O)C(Sc1cccnc1N)c2ccccc2 62a_100009888967_100000045569 [0,1,0,0,0,1|2,0,0]=4 563 B19R2.97861 CC(=O)C(Sc1cccnc1O)c2ccccc2 62a_100000760158_100009888967 [0,1,0,0,0,1|2,0,0]=4 564 B19R2.97861 CC(=O)C(Sc1cccnc1O)c2ccccc2 62a_100009888967_100000760158 [0,1,0,0,0,1|2,0,0]=4 565 B19R2.97861 CC(=O)C(Sc1ccncc1Br)c2ccccc2 62a_100000726257_100009888967 [0,1,0,0,0,1|2,0,0]=4 566 B19R2.97861 CC(=O)C(Sc1ccncc1Br)c2ccccc2 62a_100009888967_100000726257 [0,1,0,0,0,1|2,0,0]=4 567 B19R2.97861 CC(=O)C(Sc1ccncc1C)c2ccccc2 62a_100000765111_100009888967 [0,1,0,0,0,1|2,0,0]=4 568 B19R2.97861 CC(=O)C(Sc1ccncc1C)c2ccccc2 62a_100009888967_100000765111 [0,1,0,0,0,1|2,0,0]=4 569 B19R2.97861 CC(=O)C(Sc1ccncc1Cl)c2ccccc2 62a_100000708259_100009888967 [0,1,0,0,0,1|2,0,0]=4 570 B19R2.97861 CC(=O)C(Sc1ccncc1Cl)c2ccccc2 62a_100009888967_100000708259 [0,1,0,0,0,1|2,0,0]=4 571 B19R2.97861 CC(=O)C(Sc1ccncc1F)c2ccccc2 62a_100000047030_100009888967 [0,1,0,0,0,1|2,0,0]=4 572 B19R2.97861 CC(=O)C(Sc1ccncc1F)c2ccccc2 62a_100009888967_100000047030 [0,1,0,0,0,1|2,0,0]=4 573 B19R2.97861 CC(=O)C(Sc1ccncc1N)c2ccccc2 62a_100000756074_100009888967 [0,1,0,0,0,1|2,0,0]=4 574 B19R2.97861 CC(=O)C(Sc1ccncc1N)c2ccccc2 62a_100009888967_100000756074 [0,1,0,0,0,1|2,0,0]=4 575 B19R2.97861 CC(=O)C(Sc1ccncc1O)c2ccccc2 62a_100009817591_100009888967 [0,1,0,0,0,1|2,0,0]=4 576 B19R2.97861 CC(=O)C(Sc1ccncc1O)c2ccccc2 62a_100009888967_100009817591 [0,1,0,0,0,1|2,0,0]=4 577 B19R2.97861 CC(=O)C(Sc1cnccc1Br)c2ccccc2 62a_100009888967_100010138639 [0,1,0,0,0,1|2,0,0]=4 578 B19R2.97861 CC(=O)C(Sc1cnccc1Br)c2ccccc2 62a_100010138639_100009888967 [0,1,0,0,0,1|2,0,0]=4 579 B19R2.97861 CC(=O)C(Sc1cnccc1C)c2ccccc2 62a_100000761580_100009888967 [0,1,0,0,0,1|2,0,0]=4 580 B19R2.97861 CC(=O)C(Sc1cnccc1C)c2ccccc2 62a_100009888967_100000761580 [0,1,0,0,0,1|2,0,0]=4 581 B19R2.97861 CC(=O)C(Sc1cnccc1Cl)c2ccccc2 62a_100009888967_100009995489 [0,1,0,0,0,1|2,0,0]=4 582 B19R2.97861 CC(=O)C(Sc1cnccc1Cl)c2ccccc2 62a_100009995489_100009888967 [0,1,0,0,0,1|2,0,0]=4 583 B19R2.97861 CC(=O)C(Sc1cnccc1F)c2ccccc2 62a_100009820683_100009888967 [0,1,0,0,0,1|2,0,0]=4 584 B19R2.97861 CC(=O)C(Sc1cnccc1F)c2ccccc2 62a_100009888967_100009820683 [0,1,0,0,0,1|2,0,0]=4 585 B19R2.97861 CC(=O)C(Sc1cnccc1N)c2ccccc2 62a_100000047001_100009888967 [0,1,0,0,0,1|2,0,0]=4 586 B19R2.97861 CC(=O)C(Sc1cnccc1N)c2ccccc2 62a_100009888967_100000047001 [0,1,0,0,0,1|2,0,0]=4 587 B19R2.97861 CC(=O)C(Sc1ncccc1Br)c2ccccc2 62a_100000696092_100009888967 [0,1,0,0,0,1|2,0,0]=4 588 B19R2.97861 CC(=O)C(Sc1ncccc1Br)c2ccccc2 62a_100009888967_100000696092 [0,1,0,0,0,1|2,0,0]=4 589 B19R2.97861 CC(=O)C(Sc1ncccc1C)c2ccccc2 62a_100000751373_100009888967 [0,1,0,0,0,1|2,0,0]=4 590 B19R2.97861 CC(=O)C(Sc1ncccc1C)c2ccccc2 62a_100009888967_100000751373 [0,1,0,0,0,1|2,0,0]=4 591 B19R2.97861 CC(=O)C(Sc1ncccc1Cl)c2ccccc2 62a_100009888967_100011356963 [0,1,0,0,0,1|2,0,0]=4 592 B19R2.97861 CC(=O)C(Sc1ncccc1Cl)c2ccccc2 62a_100011356963_100009888967 [0,1,0,0,0,1|2,0,0]=4 593 B19R2.97861 CC(=O)C(Sc1ncccc1F)c2ccccc2 62a_100000685392_100009888967 [0,1,0,0,0,1|2,0,0]=4 594 B19R2.97861 CC(=O)C(Sc1ncccc1F)c2ccccc2 62a_100009888967_100000685392 [0,1,0,0,0,1|2,0,0]=4 595 B19R2.97861 CC(=O)C(Sc1ncccc1N)c2ccccc2 62a_100000688686_100009888967 [0,1,0,0,0,1|2,0,0]=4 596 B19R2.97861 CC(=O)C(Sc1ncccc1N)c2ccccc2 62a_100009888967_100000688686 [0,1,0,0,0,1|2,0,0]=4 597 B19R2.97861 CC(=O)C(Sc1ncccc1O)c2ccccc2 62a_100000034122_100009888967 [0,1,0,0,0,1|2,0,0]=4 598 B19R2.97861 CC(=O)C(Sc1ncccc1O)c2ccccc2 62a_100009888967_100000034122 [0,1,0,0,0,1|2,0,0]=4 599 B19R2.97861 CC(=O)N(Cc1ccccc1F)c2ccccc2 11a_100000224004_100015343762 [0,1,0,0,0,1|2,0,0]=4 600 B19R2.97861 CC(=O)N(Cc1ccccc1F)c2ccccc2 1626a_100000224004_100015343762 [0,1,0,0,0,1|2,0,0]=4 601 B19R2.97861 C[n+]1ccccc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000212160 [0,1,0,0,0,1|2,0,0]=4 602 B19R2.97861 Cc1ccccc1OC(C(=O)N)c2ccccc2 7a_100000210338_100000188848 [0,1,0,0,0,1|1,0,0]=3 603 B19R2.97861 Cc1ccccc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000210755 [0,1,0,0,0,1|1,0,0]=3 604 B19R2.97861 Cc1ccccc1SC(C(=O)N)c2ccccc2 62a_100000210755_100000188848 [0,1,0,0,0,1|1,0,0]=3 605 B19R2.97861 Cc1cccnc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000751373 [0,1,0,0,0,1|2,0,0]=4 606 B19R2.97861 Cc1cccnc1SC(C(=O)N)c2ccccc2 62a_100000751373_100000188848 [0,1,0,0,0,1|2,0,0]=4 607 B19R2.97861 Cc1ccncc1OC(C(=O)N)c2ccccc2 7a_100011997053_100000188848 [0,1,0,0,0,1|2,0,0]=4 608 B19R2.97861 Cc1ccncc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000761580 [0,1,0,0,0,1|2,0,0]=4 609 B19R2.97861 Cc1ccncc1SC(C(=O)N)c2ccccc2 62a_100000761580_100000188848 [0,1,0,0,0,1|2,0,0]=4 610 B19R2.97861 Cc1cnccc1N[C@@H](C(=O)N)c2ccccc2 27a_100011423151_100000765111 [0,1,0,0,0,1|2,0,0]=4 611 B19R2.97861 Cc1cnccc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000765111 [0,1,0,0,0,1|2,0,0]=4 612 B19R2.97861 Cc1cnccc1SC(C(=O)N)c2ccccc2 62a_100000765111_100000188848 [0,1,0,0,0,1|2,0,0]=4 613 B19R2.97861 Cc1ncccc1OC(C(=O)N)c2ccccc2 7a_100000745507_100000188848 [0,1,0,0,0,1|2,0,0]=4 614 B19R2.97861 Cc1ncccc1SC(C(=O)N)c2ccccc2 62a_100000188848_100000751574 [0,1,0,0,0,1|2,0,0]=4 615 B19R2.97861 Cc1ncccc1SC(C(=O)N)c2ccccc2 62a_100000751574_100000188848 [0,1,0,0,0,1|2,0,0]=4 616 B19R2.97861 NC(=O)C(Oc1cccc[n+]1[O-])c2ccccc2 7a_100000211761_100000188848 [0,1,0,0,0,1|2,0,0]=4 617 B19R2.97861 NC(=O)C(Oc1ccccc1Br)c2ccccc2 7a_100000181306_100000188848 [0,1,0,0,0,1|1,0,0]=3 618 B19R2.97861 NC(=O)C(Oc1ccccc1Cl)c2ccccc2 7a_100000210172_100000188848 [0,1,0,0,0,1|1,0,0]=3 619 B19R2.97861 NC(=O)C(Oc1ccccc1F)c2ccccc2 7a_100000210171_100000188848 [0,1,0,0,0,1|1,0,0]=3 620 B19R2.97861 NC(=O)C(Oc1ccccc1I)c2ccccc2 7a_100000739446_100000188848 [0,1,0,0,0,1|1,0,0]=3 621 B19R2.97861 NC(=O)C(Oc1ccccc1N)c2ccccc2 7a_100000185747_100000188848 [0,1,0,0,0,1|1,0,0]=3 622 B19R2.97861 NC(=O)C(Oc1cccnc1Br)c2ccccc2 7a_100000744436_100000188848 [0,1,0,0,0,1|2,0,0]=4 623 B19R2.97861 NC(=O)C(Oc1cccnc1Cl)c2ccccc2 7a_100000757616_100000188848 [0,1,0,0,0,1|2,0,0]=4 624 B19R2.97861 NC(=O)C(Oc1cccnc1F)c2ccccc2 7a_100000061740_100000188848 [0,1,0,0,0,1|2,0,0]=4 625 B19R2.97861 NC(=O)C(Oc1cccnc1I)c2ccccc2 7a_100000034122_100000188848 [0,1,0,0,0,1|2,0,0]=4 626 B19R2.97861 NC(=O)C(Oc1cccnc1N)c2ccccc2 7a_100000211975_100000188848 [0,1,0,0,0,1|2,0,0]=4 627 B19R2.97861 NC(=O)C(Oc1cccoc1=O)c2ccccc2 7a_100000077404_100000188848 [0,1,0,0,0,1|2,0,0]=4 628 B19R2.97861 NC(=O)C(Sc1c[nH]ccc1=O)c2ccccc2 62a_100000188848_100009998708 [0,1,0,0,0,1|2,0,0]=4 629 B19R2.97861 NC(=O)C(Sc1c[nH]ccc1=O)c2ccccc2 62a_100009998708_100000188848 [0,1,0,0,0,1|2,0,0]=4 630 B19R2.97861 NC(=O)C(Sc1c[nH]ccc1=S)c2ccccc2 62a_100000188848_200012280681 [0,1,0,0,0,1|2,0,0]=4 631 B19R2.97861 NC(=O)C(Sc1c[nH]ccc1=S)c2ccccc2 62a_200012280681_100000188848 [0,1,0,0,0,1|2,0,0]=4 632 B19R2.97861 NC(=O)C(Sc1cccc[n+]1[O-])c2ccccc2 62a_100000188848_200000042595 [0,1,0,0,0,1|2,0,0]=4 633 B19R2.97861 NC(=O)C(Sc1ccccc1Br)c2ccccc2 62a_100000188848_100000695589 [0,1,0,0,0,1|1,0,0]=3 634 B19R2.97861 NC(=O)C(Sc1ccccc1Br)c2ccccc2 62a_100000695589_100000188848 [0,1,0,0,0,1|1,0,0]=3 635 B19R2.97861 NC(=O)C(Sc1ccccc1Cl)c2ccccc2 62a_100000188848_100000764095 [0,1,0,0,0,1|1,0,0]=3 636 B19R2.97861 NC(=O)C(Sc1ccccc1Cl)c2ccccc2 62a_100000764095_100000188848 [0,1,0,0,0,1|1,0,0]=3 637 B19R2.97861 NC(=O)C(Sc1ccccc1F)c2ccccc2 62a_100000188848_100011215700 [0,1,0,0,0,1|1,0,0]=3 638 B19R2.97861 NC(=O)C(Sc1ccccc1F)c2ccccc2 62a_100011215700_100000188848 [0,1,0,0,0,1|1,0,0]=3 639 B19R2.97861 NC(=O)C(Sc1ccccc1N)c2ccccc2 62a_100000188848_100000210017 [0,1,0,0,0,1|1,0,0]=3 640 B19R2.97861 NC(=O)C(Sc1ccccc1N)c2ccccc2 62a_100000210017_100000188848 [0,1,0,0,0,1|1,0,0]=3 641 B19R2.97861 NC(=O)C(Sc1ccccc1O)c2ccccc2 62a_100000188848_100000739446 [0,1,0,0,0,1|1,0,0]=3 642 B19R2.97861 NC(=O)C(Sc1ccccc1O)c2ccccc2 62a_100000739446_100000188848 [0,1,0,0,0,1|1,0,0]=3 643 B19R2.97861 NC(=O)C(Sc1cccnc1Br)c2ccccc2 62a_100000188848_100010202626 [0,1,0,0,0,1|2,0,0]=4 644 B19R2.97861 NC(=O)C(Sc1cccnc1Br)c2ccccc2 62a_100010202626_100000188848 [0,1,0,0,0,1|2,0,0]=4 645 B19R2.97861 NC(=O)C(Sc1cccnc1Cl)c2ccccc2 62a_100000036424_100000188848 [0,1,0,0,0,1|2,0,0]=4 646 B19R2.97861 NC(=O)C(Sc1cccnc1Cl)c2ccccc2 62a_100000188848_100000036424 [0,1,0,0,0,1|2,0,0]=4 647 B19R2.97861 NC(=O)C(Sc1cccnc1F)c2ccccc2 62a_100000188848_100009816115 [0,1,0,0,0,1|2,0,0]=4 648 B19R2.97861 NC(=O)C(Sc1cccnc1F)c2ccccc2 62a_100009816115_100000188848 [0,1,0,0,0,1|2,0,0]=4 649 B19R2.97861 NC(=O)C(Sc1cccnc1N)c2ccccc2 62a_100000045569_100000188848 [0,1,0,0,0,1|2,0,0]=4 650 B19R2.97861 NC(=O)C(Sc1cccnc1N)c2ccccc2 62a_100000188848_100000045569 [0,1,0,0,0,1|2,0,0]=4 651 B19R2.97861 NC(=O)C(Sc1cccnc1O)c2ccccc2 62a_100000188848_100000760158 [0,1,0,0,0,1|2,0,0]=4 652 B19R2.97861 NC(=O)C(Sc1cccnc1O)c2ccccc2 62a_100000760158_100000188848 [0,1,0,0,0,1|2,0,0]=4 653 B19R2.97861 NC(=O)C(Sc1ccncc1Br)c2ccccc2 62a_100000188848_100000726257 [0,1,0,0,0,1|2,0,0]=4 654 B19R2.97861 NC(=O)C(Sc1ccncc1Br)c2ccccc2 62a_100000726257_100000188848 [0,1,0,0,0,1|2,0,0]=4 655 B19R2.97861 NC(=O)C(Sc1ccncc1Cl)c2ccccc2 62a_100000188848_100000708259 [0,1,0,0,0,1|2,0,0]=4 656 B19R2.97861 NC(=O)C(Sc1ccncc1Cl)c2ccccc2 62a_100000708259_100000188848 [0,1,0,0,0,1|2,0,0]=4 657 B19R2.97861 NC(=O)C(Sc1ccncc1F)c2ccccc2 62a_100000047030_100000188848 [0,1,0,0,0,1|2,0,0]=4 658 B19R2.97861 NC(=O)C(Sc1ccncc1F)c2ccccc2 62a_100000188848_100000047030 [0,1,0,0,0,1|2,0,0]=4 659 B19R2.97861 NC(=O)C(Sc1ccncc1N)c2ccccc2 62a_100000188848_100000756074 [0,1,0,0,0,1|2,0,0]=4 660 B19R2.97861 NC(=O)C(Sc1ccncc1N)c2ccccc2 62a_100000756074_100000188848 [0,1,0,0,0,1|2,0,0]=4 661 B19R2.97861 NC(=O)C(Sc1ccncc1O)c2ccccc2 62a_100000188848_100009817591 [0,1,0,0,0,1|2,0,0]=4 662 B19R2.97861 NC(=O)C(Sc1ccncc1O)c2ccccc2 62a_100009817591_100000188848 [0,1,0,0,0,1|2,0,0]=4 663 B19R2.97861 NC(=O)C(Sc1cnccc1Br)c2ccccc2 62a_100000188848_100010138639 [0,1,0,0,0,1|2,0,0]=4 664 B19R2.97861 NC(=O)C(Sc1cnccc1Br)c2ccccc2 62a_100010138639_100000188848 [0,1,0,0,0,1|2,0,0]=4 665 B19R2.97861 NC(=O)C(Sc1cnccc1Cl)c2ccccc2 62a_100000188848_100009995489 [0,1,0,0,0,1|2,0,0]=4 666 B19R2.97861 NC(=O)C(Sc1cnccc1Cl)c2ccccc2 62a_100009995489_100000188848 [0,1,0,0,0,1|2,0,0]=4 667 B19R2.97861 NC(=O)C(Sc1cnccc1F)c2ccccc2 62a_100000188848_100009820683 [0,1,0,0,0,1|2,0,0]=4 668 B19R2.97861 NC(=O)C(Sc1cnccc1F)c2ccccc2 62a_100009820683_100000188848 [0,1,0,0,0,1|2,0,0]=4 669 B19R2.97861 NC(=O)C(Sc1cnccc1N)c2ccccc2 62a_100000047001_100000188848 [0,1,0,0,0,1|2,0,0]=4 670 B19R2.97861 NC(=O)C(Sc1cnccc1N)c2ccccc2 62a_100000188848_100000047001 [0,1,0,0,0,1|2,0,0]=4 671 B19R2.97861 NC(=O)C(Sc1ncccc1Br)c2ccccc2 62a_100000188848_100000696092 [0,1,0,0,0,1|2,0,0]=4 672 B19R2.97861 NC(=O)C(Sc1ncccc1Br)c2ccccc2 62a_100000696092_100000188848 [0,1,0,0,0,1|2,0,0]=4 673 B19R2.97861 NC(=O)C(Sc1ncccc1Cl)c2ccccc2 62a_100000188848_100011356963 [0,1,0,0,0,1|2,0,0]=4 674 B19R2.97861 NC(=O)C(Sc1ncccc1Cl)c2ccccc2 62a_100011356963_100000188848 [0,1,0,0,0,1|2,0,0]=4 675 B19R2.97861 NC(=O)C(Sc1ncccc1F)c2ccccc2 62a_100000188848_100000685392 [0,1,0,0,0,1|2,0,0]=4 676 B19R2.97861 NC(=O)C(Sc1ncccc1F)c2ccccc2 62a_100000685392_100000188848 [0,1,0,0,0,1|2,0,0]=4 677 B19R2.97861 NC(=O)C(Sc1ncccc1N)c2ccccc2 62a_100000188848_100000688686 [0,1,0,0,0,1|2,0,0]=4 678 B19R2.97861 NC(=O)C(Sc1ncccc1N)c2ccccc2 62a_100000688686_100000188848 [0,1,0,0,0,1|2,0,0]=4 679 B19R2.97861 NC(=O)C(Sc1ncccc1O)c2ccccc2 62a_100000034122_100000188848 [0,1,0,0,0,1|2,0,0]=4 680 B19R2.97861 NC(=O)C(Sc1ncccc1O)c2ccccc2 62a_100000188848_100000034122 [0,1,0,0,0,1|2,0,0]=4 681 B19R2.97861 NC(=O)[C@H](Nc1ccncc1Br)c2ccccc2 27a_100011423151_100000726257 [0,1,0,0,0,1|2,0,0]=4 682 B19R2.97861 NC(=O)[C@H](Nc1ccncc1F)c2ccccc2 27a_100011423151_100000035921 [0,1,0,0,0,1|2,0,0]=4 683 B19R2.97861 NC(=O)[C@H](Nc1ncccc1Br)c2ccccc2 27a_100011423151_100000696092 [0,1,0,0,0,1|2,0,0]=4 684 B19R2.97861 [13CH3]C(=O)C(Sc1ccccc1F)c2ccccc2 1458a_100000594731_200025704644 [0,1,0,0,0,1|1,0,0]=3 685 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)Br 11a_100000224063_100015343762 [0,1,0,0,0,1|2,0,0]=4 686 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)Br 1626a_100000224063_100015343762 [0,1,0,0,0,1|2,0,0]=4 687 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)C 11a_100000185206_100015343762 [0,1,0,0,0,1|2,0,0]=4 688 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)C 1626a_100000185206_100015343762 [0,1,0,0,0,1|2,0,0]=4 689 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)C 22a_100000185206_100000070787 [0,1,0,0,0,1|2,0,0]=4 690 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)Cl 11a_100102953027_100015343762 [0,1,0,0,0,1|2,0,0]=4 691 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)Cl 1626a_100102953027_100015343762 [0,1,0,0,0,1|2,0,0]=4 692 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)F 11a_100102952868_100015343762 [0,1,0,0,0,1|2,0,0]=4 693 B19R2.101681 CC(=O)N(Cc1ccccc1)c2cccc(c2)F 1626a_100102952868_100015343762 [0,1,0,0,0,1|2,0,0]=4 694 B19R2.113617 CC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000070787_100000211254 [0,1,0,0,0,1|1,0,0]=3 695 B19R2.113617 CC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100009888967 [0,1,0,0,0,1|1,0,0]=3 696 B19R2.113617 CC(=O)C(c1ccccc1)N(C)c2ccccc2 2230a_100000210012_100009888967 [0,1,0,0,0,1|1,0,0]=3 697 B19R2.113617 CC(=O)C(c1ccccc1)N(C)c2ccccc2 269982a_100000210012_100009888967 [0,1,0,0,0,1|1,0,0]=3 698 B19R2.113617 CN(c1ccccc1)C(C(=O)N)c2ccccc2 2230a_100000210012_100000188848 [0,1,0,0,0,1|1,0,0]=3 699 B19R2.113617 CN(c1ccccc1)C(C(=O)N)c2ccccc2 269982a_100000210012_100000188848 [0,1,0,0,0,1|1,0,0]=3 700 B19R2.113617 CN(c1ccccc1)C(C(=O)O)c2ccccc2 269956a_100005477724_200000210301 [0,1,0,0,0,1|0,0,0]=2 701 B19R2.113617 NC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000188848 [0,1,0,0,0,1|1,0,0]=3 702 B19R2.113617 [13CH3]N(c1ccccc1)C(C(=O)O)c2ccccc2 269956a_100005477724_200025704644 [0,1,0,0,0,1|0,0,0]=2 703 B19R2.151568 CC(=O)C(=Cc1ccc(cc1)O)c2ccccc2 1458a_200000407273_200000210301 [0,1,0,0,0,1|1,0,1]=4 704 B19R2.151568 CC(=O)C(Nc1ccc(cc1)Br)c2ccccc2 2230a_100000210018_100009888967 [0,1,0,0,0,1|1,0,0]=3 705 B19R2.151568 CC(=O)C(Nc1ccc(cc1)Cl)c2ccccc2 2230a_100000210052_100009888967 [0,1,0,0,0,1|1,0,0]=3 706 B19R2.151568 CC(=O)C(Oc1ccc(cc1)Br)c2ccccc2 7a_100000185759_100009888967 [0,1,0,0,0,1|1,0,0]=3 707 B19R2.151568 CC(=O)C(Oc1ccc(cc1)C)c2ccccc2 7a_100000210336_100009888967 [0,1,0,0,0,1|1,0,0]=3 708 B19R2.151568 CC(=O)C(Oc1ccc(cc1)Cl)c2ccccc2 7a_100000210216_100009888967 [0,1,0,0,0,1|1,0,0]=3 709 B19R2.151568 CC(=O)C(Oc1ccc(cc1)I)c2ccccc2 7a_100000212066_100009888967 [0,1,0,0,0,1|1,0,0]=3 710 B19R2.151568 CC(=O)C(Oc1ccc(nc1)Br)c2ccccc2 7a_100000685995_100009888967 [0,1,0,0,0,1|2,0,0]=4 711 B19R2.151568 CC(=O)C(Oc1ccc(nc1)C)c2ccccc2 7a_100000745506_100009888967 [0,1,0,0,0,1|2,0,0]=4 712 B19R2.151568 CC(=O)C(Oc1ccc(nc1)Cl)c2ccccc2 7a_100000744096_100009888967 [0,1,0,0,0,1|2,0,0]=4 713 B19R2.151568 CC(=O)C(Oc1ccc(nc1)F)c2ccccc2 7a_100000688820_100009888967 [0,1,0,0,0,1|2,0,0]=4 714 B19R2.151568 CC(=O)C(Oc1ccc(nc1)I)c2ccccc2 7a_100000687607_100009888967 [0,1,0,0,0,1|2,0,0]=4 715 B19R2.151568 CC(=O)C(Oc1ccc(nc1)N)c2ccccc2 7a_100015188713_100009888967 [0,1,0,0,0,1|2,0,0]=4 716 B19R2.151568 CC(=O)C(Sc1cc[n+](cc1)[O-])c2ccccc2 62a_100009888967_100000039755 [0,1,0,0,0,1|2,0,0]=4 717 B19R2.151568 CC(=O)C(Sc1ccc(=O)[nH]c1)c2ccccc2 62a_100000212171_100009888967 [0,1,0,0,0,1|2,0,0]=4 718 B19R2.151568 CC(=O)C(Sc1ccc(=O)[nH]c1)c2ccccc2 62a_100009888967_100000212171 [0,1,0,0,0,1|2,0,0]=4 719 B19R2.151568 CC(=O)C(Sc1ccc(cc1)Br)c2ccccc2 62a_100000752885_100009888967 [0,1,0,0,0,1|1,0,0]=3 720 B19R2.151568 CC(=O)C(Sc1ccc(cc1)Br)c2ccccc2 62a_100009888967_100000752885 [0,1,0,0,0,1|1,0,0]=3 721 B19R2.151568 CC(=O)C(Sc1ccc(cc1)C)c2ccccc2 62a_100000186775_100009888967 [0,1,0,0,0,1|1,0,0]=3 722 B19R2.151568 CC(=O)C(Sc1ccc(cc1)C)c2ccccc2 62a_100009888967_100000186775 [0,1,0,0,0,1|1,0,0]=3 723 B19R2.151568 CC(=O)C(Sc1ccc(cc1)Cl)c2ccccc2 62a_100000755918_100009888967 [0,1,0,0,0,1|1,0,0]=3 724 B19R2.151568 CC(=O)C(Sc1ccc(cc1)Cl)c2ccccc2 62a_100009888967_100000755918 [0,1,0,0,0,1|1,0,0]=3 725 B19R2.151568 CC(=O)C(Sc1ccc(cc1)F)c2ccccc2 62a_100000211213_100009888967 [0,1,0,0,0,1|1,0,0]=3 726 B19R2.151568 CC(=O)C(Sc1ccc(cc1)F)c2ccccc2 62a_100009888967_100000211213 [0,1,0,0,0,1|1,0,0]=3 727 B19R2.151568 CC(=O)C(Sc1ccc(cc1)N)c2ccccc2 62a_100000185761_100009888967 [0,1,0,0,0,1|1,0,0]=3 728 B19R2.151568 CC(=O)C(Sc1ccc(cc1)N)c2ccccc2 62a_100009888967_100000185761 [0,1,0,0,0,1|1,0,0]=3 729 B19R2.151568 CC(=O)C(Sc1ccc(cc1)O)c2ccccc2 62a_100009888967_100000185759 [0,1,0,0,0,1|1,0,0]=3 730 B19R2.151568 CC(=O)C(Sc1ccc(cn1)Br)c2ccccc2 62a_100000686858_100009888967 [0,1,0,0,0,1|2,0,0]=4 731 B19R2.151568 CC(=O)C(Sc1ccc(cn1)Br)c2ccccc2 62a_100009888967_100000686858 [0,1,0,0,0,1|2,0,0]=4 732 B19R2.151568 CC(=O)C(Sc1ccc(cn1)C)c2ccccc2 62a_100009888967_100000754016 [0,1,0,0,0,1|2,0,0]=4 733 B19R2.151568 CC(=O)C(Sc1ccc(cn1)C)c2ccccc2 62a_100011192072_100009888967 [0,1,0,0,0,1|2,0,0]=4 734 B19R2.151568 CC(=O)C(Sc1ccc(cn1)Cl)c2ccccc2 62a_100009888967_100011356976 [0,1,0,0,0,1|2,0,0]=4 735 B19R2.151568 CC(=O)C(Sc1ccc(cn1)Cl)c2ccccc2 62a_100011356976_100009888967 [0,1,0,0,0,1|2,0,0]=4 736 B19R2.151568 CC(=O)C(Sc1ccc(cn1)F)c2ccccc2 62a_100000744514_100009888967 [0,1,0,0,0,1|2,0,0]=4 737 B19R2.151568 CC(=O)C(Sc1ccc(cn1)F)c2ccccc2 62a_100009888967_100000744514 [0,1,0,0,0,1|2,0,0]=4 738 B19R2.151568 CC(=O)C(Sc1ccc(cn1)N)c2ccccc2 62a_100000737798_100009888967 [0,1,0,0,0,1|2,0,0]=4 739 B19R2.151568 CC(=O)C(Sc1ccc(cn1)N)c2ccccc2 62a_100009888967_100000737798 [0,1,0,0,0,1|2,0,0]=4 740 B19R2.151568 CC(=O)C(Sc1ccc(cn1)O)c2ccccc2 62a_100000685995_100009888967 [0,1,0,0,0,1|2,0,0]=4 741 B19R2.151568 CC(=O)C(Sc1ccc(cn1)O)c2ccccc2 62a_100009888967_100000744096 [0,1,0,0,0,1|2,0,0]=4 742 B19R2.151568 CC(=O)C(Sc1ccc(nc1)Br)c2ccccc2 62a_100009814638_100009888967 [0,1,0,0,0,1|2,0,0]=4 743 B19R2.151568 CC(=O)C(Sc1ccc(nc1)Br)c2ccccc2 62a_100009888967_100009814638 [0,1,0,0,0,1|2,0,0]=4 744 B19R2.151568 CC(=O)C(Sc1ccc(nc1)C)c2ccccc2 62a_100000751577_100009888967 [0,1,0,0,0,1|2,0,0]=4 745 B19R2.151568 CC(=O)C(Sc1ccc(nc1)C)c2ccccc2 62a_100009888967_100000751577 [0,1,0,0,0,1|2,0,0]=4 746 B19R2.151568 CC(=O)C(Sc1ccc(nc1)Cl)c2ccccc2 62a_100000034144_100009888967 [0,1,0,0,0,1|2,0,0]=4 747 B19R2.151568 CC(=O)C(Sc1ccc(nc1)Cl)c2ccccc2 62a_100009888967_100000034144 [0,1,0,0,0,1|2,0,0]=4 748 B19R2.151568 CC(=O)C(Sc1ccc(nc1)F)c2ccccc2 62a_100000042367_100009888967 [0,1,0,0,0,1|2,0,0]=4 749 B19R2.151568 CC(=O)C(Sc1ccc(nc1)F)c2ccccc2 62a_100009888967_100000042367 [0,1,0,0,0,1|2,0,0]=4 750 B19R2.151568 CC(=O)C(Sc1ccc(nc1)N)c2ccccc2 62a_100000187370_100009888967 [0,1,0,0,0,1|2,0,0]=4 751 B19R2.151568 CC(=O)C(Sc1ccc(nc1)N)c2ccccc2 62a_100009888967_100000187370 [0,1,0,0,0,1|2,0,0]=4 752 B19R2.151568 Cc1ccc(cc1)OC(C(=O)N)c2ccccc2 7a_100000210336_100000188848 [0,1,0,0,0,1|1,0,0]=3 753 B19R2.151568 Cc1ccc(cc1)SC(C(=O)N)c2ccccc2 62a_100000186775_100000188848 [0,1,0,0,0,1|1,0,0]=3 754 B19R2.151568 Cc1ccc(cc1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000186775 [0,1,0,0,0,1|1,0,0]=3 755 B19R2.151568 Cc1ccc(cn1)OC(C(=O)N)c2ccccc2 7a_100000745506_100000188848 [0,1,0,0,0,1|2,0,0]=4 756 B19R2.151568 Cc1ccc(cn1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000751577 [0,1,0,0,0,1|2,0,0]=4 757 B19R2.151568 Cc1ccc(cn1)SC(C(=O)N)c2ccccc2 62a_100000751577_100000188848 [0,1,0,0,0,1|2,0,0]=4 758 B19R2.151568 Cc1ccc(nc1)SC(C(=O)N)c2ccccc2 62a_100000188848_100000754016 [0,1,0,0,0,1|2,0,0]=4 759 B19R2.151568 Cc1ccc(nc1)SC(C(=O)N)c2ccccc2 62a_100011192072_100000188848 [0,1,0,0,0,1|2,0,0]=4 760 B19R2.151568 NC(=O)C(Nc1ccc(cc1)Br)c2ccccc2 2230a_100000210018_100000188848 [0,1,0,0,0,1|1,0,0]=3 761 B19R2.151568 NC(=O)C(Nc1ccc(cc1)Cl)c2ccccc2 2230a_100000210052_100000188848 [0,1,0,0,0,1|1,0,0]=3 762 B19R2.151568 NC(=O)C(Oc1ccc(cc1)Br)c2ccccc2 7a_100000185759_100000188848 [0,1,0,0,0,1|1,0,0]=3 763 B19R2.151568 NC(=O)C(Oc1ccc(cc1)Cl)c2ccccc2 7a_100000210216_100000188848 [0,1,0,0,0,1|1,0,0]=3 764 B19R2.151568 NC(=O)C(Oc1ccc(cc1)I)c2ccccc2 7a_100000212066_100000188848 [0,1,0,0,0,1|1,0,0]=3 765 B19R2.151568 NC(=O)C(Oc1ccc(nc1)Br)c2ccccc2 7a_100000685995_100000188848 [0,1,0,0,0,1|2,0,0]=4 766 B19R2.151568 NC(=O)C(Oc1ccc(nc1)Cl)c2ccccc2 7a_100000744096_100000188848 [0,1,0,0,0,1|2,0,0]=4 767 B19R2.151568 NC(=O)C(Oc1ccc(nc1)F)c2ccccc2 7a_100000688820_100000188848 [0,1,0,0,0,1|2,0,0]=4 768 B19R2.151568 NC(=O)C(Oc1ccc(nc1)I)c2ccccc2 7a_100000687607_100000188848 [0,1,0,0,0,1|2,0,0]=4 769 B19R2.151568 NC(=O)C(Oc1ccc(nc1)N)c2ccccc2 7a_100015188713_100000188848 [0,1,0,0,0,1|2,0,0]=4 770 B19R2.151568 NC(=O)C(Sc1cc[n+](cc1)[O-])c2ccccc2 62a_100000188848_100000039755 [0,1,0,0,0,1|2,0,0]=4 771 B19R2.151568 NC(=O)C(Sc1ccc(=O)[nH]c1)c2ccccc2 62a_100000188848_100000212171 [0,1,0,0,0,1|2,0,0]=4 772 B19R2.151568 NC(=O)C(Sc1ccc(=O)[nH]c1)c2ccccc2 62a_100000212171_100000188848 [0,1,0,0,0,1|2,0,0]=4 773 B19R2.151568 NC(=O)C(Sc1ccc(cc1)Br)c2ccccc2 62a_100000188848_100000752885 [0,1,0,0,0,1|1,0,0]=3 774 B19R2.151568 NC(=O)C(Sc1ccc(cc1)Br)c2ccccc2 62a_100000752885_100000188848 [0,1,0,0,0,1|1,0,0]=3 775 B19R2.151568 NC(=O)C(Sc1ccc(cc1)Cl)c2ccccc2 62a_100000188848_100000755918 [0,1,0,0,0,1|1,0,0]=3 776 B19R2.151568 NC(=O)C(Sc1ccc(cc1)Cl)c2ccccc2 62a_100000755918_100000188848 [0,1,0,0,0,1|1,0,0]=3 777 B19R2.151568 NC(=O)C(Sc1ccc(cc1)F)c2ccccc2 62a_100000188848_100000211213 [0,1,0,0,0,1|1,0,0]=3 778 B19R2.151568 NC(=O)C(Sc1ccc(cc1)F)c2ccccc2 62a_100000211213_100000188848 [0,1,0,0,0,1|1,0,0]=3 779 B19R2.151568 NC(=O)C(Sc1ccc(cc1)N)c2ccccc2 62a_100000185761_100000188848 [0,1,0,0,0,1|1,0,0]=3 780 B19R2.151568 NC(=O)C(Sc1ccc(cc1)N)c2ccccc2 62a_100000188848_100000185761 [0,1,0,0,0,1|1,0,0]=3 781 B19R2.151568 NC(=O)C(Sc1ccc(cc1)O)c2ccccc2 62a_100000188848_100000185759 [0,1,0,0,0,1|1,0,0]=3 782 B19R2.151568 NC(=O)C(Sc1ccc(cn1)Br)c2ccccc2 62a_100000188848_100000686858 [0,1,0,0,0,1|2,0,0]=4 783 B19R2.151568 NC(=O)C(Sc1ccc(cn1)Br)c2ccccc2 62a_100000686858_100000188848 [0,1,0,0,0,1|2,0,0]=4 784 B19R2.151568 NC(=O)C(Sc1ccc(cn1)Cl)c2ccccc2 62a_100000188848_100011356976 [0,1,0,0,0,1|2,0,0]=4 785 B19R2.151568 NC(=O)C(Sc1ccc(cn1)Cl)c2ccccc2 62a_100011356976_100000188848 [0,1,0,0,0,1|2,0,0]=4 786 B19R2.151568 NC(=O)C(Sc1ccc(cn1)F)c2ccccc2 62a_100000188848_100000744514 [0,1,0,0,0,1|2,0,0]=4 787 B19R2.151568 NC(=O)C(Sc1ccc(cn1)F)c2ccccc2 62a_100000744514_100000188848 [0,1,0,0,0,1|2,0,0]=4 788 B19R2.151568 NC(=O)C(Sc1ccc(cn1)N)c2ccccc2 62a_100000188848_100000737798 [0,1,0,0,0,1|2,0,0]=4 789 B19R2.151568 NC(=O)C(Sc1ccc(cn1)N)c2ccccc2 62a_100000737798_100000188848 [0,1,0,0,0,1|2,0,0]=4 790 B19R2.151568 NC(=O)C(Sc1ccc(cn1)O)c2ccccc2 62a_100000188848_100000744096 [0,1,0,0,0,1|2,0,0]=4 791 B19R2.151568 NC(=O)C(Sc1ccc(cn1)O)c2ccccc2 62a_100000685995_100000188848 [0,1,0,0,0,1|2,0,0]=4 792 B19R2.151568 NC(=O)C(Sc1ccc(nc1)Br)c2ccccc2 62a_100000188848_100009814638 [0,1,0,0,0,1|2,0,0]=4 793 B19R2.151568 NC(=O)C(Sc1ccc(nc1)Br)c2ccccc2 62a_100009814638_100000188848 [0,1,0,0,0,1|2,0,0]=4 794 B19R2.151568 NC(=O)C(Sc1ccc(nc1)Cl)c2ccccc2 62a_100000034144_100000188848 [0,1,0,0,0,1|2,0,0]=4 795 B19R2.151568 NC(=O)C(Sc1ccc(nc1)Cl)c2ccccc2 62a_100000188848_100000034144 [0,1,0,0,0,1|2,0,0]=4 796 B19R2.151568 NC(=O)C(Sc1ccc(nc1)F)c2ccccc2 62a_100000042367_100000188848 [0,1,0,0,0,1|2,0,0]=4 797 B19R2.151568 NC(=O)C(Sc1ccc(nc1)F)c2ccccc2 62a_100000188848_100000042367 [0,1,0,0,0,1|2,0,0]=4 798 B19R2.151568 NC(=O)C(Sc1ccc(nc1)N)c2ccccc2 62a_100000187370_100000188848 [0,1,0,0,0,1|2,0,0]=4 799 B19R2.151568 NC(=O)C(Sc1ccc(nc1)N)c2ccccc2 62a_100000188848_100000187370 [0,1,0,0,0,1|2,0,0]=4 800 B19R2.151568 NC(=O)[C@H](Nc1ccc(cn1)Br)c2ccccc2 27a_100011423151_100000686858 [0,1,0,0,0,1|2,0,0]=4 801 B19R2.151568 [13CH3]C(=O)C(=Cc1ccc(cc1)O)c2ccccc2 1458a_200000407273_200025704644 [0,1,0,0,0,1|1,0,1]=4 802 B19R2.7170 CC(=O)CC(c1ccccc1)c2ccccc2Cl 1458a_100015187286_200000210301 [0,1,0,0,0,1|1,0,0]=3 803 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2Br 11a_100011211563_100015343762 [0,1,0,0,0,1|1,0,0]=3 804 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2Br 1626a_100011211563_100015343762 [0,1,0,0,0,1|1,0,0]=3 805 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2Br 240690a_100011211563_100015343762 [0,1,0,0,0,1|1,0,0]=3 806 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2Br 527a_100011211563_100103153847 [0,1,0,0,0,1|1,0,0]=3 807 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2C 11a_100000222801_100015343762 [0,1,0,0,0,1|1,0,0]=3 808 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2C 1626a_100000222801_100015343762 [0,1,0,0,0,1|1,0,0]=3 809 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2C 240690a_100000222801_100015343762 [0,1,0,0,0,1|1,0,0]=3 810 B19R2.7170 CC(=O)NC(c1ccccc1)c2ccccc2C 527a_100000222801_100103153847 [0,1,0,0,0,1|1,0,0]=3 811 B19R2.7170 CC(=O)NC(c1ccncc1)c2ccccc2C 1626a_100015184055_100015343762 [0,1,0,0,0,1|2,0,0]=4 812 B19R2.7170 CC(=O)NC(c1ccncc1)c2ccccc2C 240690a_100015184055_100015343762 [0,1,0,0,0,1|2,0,0]=4 813 B19R2.7170 CC(=O)NC(c1ccncc1)c2ccccc2C 527a_100015184055_100103153847 [0,1,0,0,0,1|2,0,0]=4 814 B19R2.7170 [13CH3]C(=O)CC(c1ccccc1)c2ccccc2Cl 1458a_100015187286_200025704644 [0,1,0,0,0,1|1,0,0]=3 815 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 11a_100000745999_100015343762 [0,1,0,0,0,1|1,0,0]=3 816 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 1626a_100000745999_100015343762 [0,1,0,0,0,1|1,0,0]=3 817 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 240690a_100000745999_100015343762 [0,1,0,0,0,1|1,0,0]=3 818 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Br 527a_100000745999_100103153847 [0,1,0,0,0,1|1,0,0]=3 819 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)C 11a_100000736602_100015343762 [0,1,0,0,0,1|1,0,0]=3 820 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)C 1626a_100000736602_100015343762 [0,1,0,0,0,1|1,0,0]=3 821 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)C 240690a_100000736602_100015343762 [0,1,0,0,0,1|1,0,0]=3 822 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)C 527a_100000736602_100103153847 [0,1,0,0,0,1|1,0,0]=3 823 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 11a_100000737946_100015343762 [0,1,0,0,0,1|1,0,0]=3 824 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 1626a_100000737946_100015343762 [0,1,0,0,0,1|1,0,0]=3 825 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 240690a_100000737946_100015343762 [0,1,0,0,0,1|1,0,0]=3 826 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)Cl 527a_100000737946_100103153847 [0,1,0,0,0,1|1,0,0]=3 827 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)F 11a_100000737529_100015343762 [0,1,0,0,0,1|1,0,0]=3 828 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)F 1626a_100000737529_100015343762 [0,1,0,0,0,1|1,0,0]=3 829 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)F 240690a_100000737529_100015343762 [0,1,0,0,0,1|1,0,0]=3 830 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)F 527a_100000737529_100103153847 [0,1,0,0,0,1|1,0,0]=3 831 B19R2.12362 CC(=O)NC(c1ccccc1)c2ccc(cc2)O 240690a_100000198503_100015343762 [0,1,0,0,0,1|1,0,0]=3 832 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)C 1626a_200015185284_100015343762 [0,1,0,0,0,1|2,0,0]=4 833 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)C 240690a_200015185284_100015343762 [0,1,0,0,0,1|2,0,0]=4 834 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)C 527a_200015185284_100103153847 [0,1,0,0,0,1|2,0,0]=4 835 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)F 1626a_100000751741_100015343762 [0,1,0,0,0,1|2,0,0]=4 836 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)F 240690a_100000751741_100015343762 [0,1,0,0,0,1|2,0,0]=4 837 B19R2.12362 CC(=O)NC(c1ccncc1)c2ccc(cc2)F 527a_100000751741_100103153847 [0,1,0,0,0,1|2,0,0]=4 838 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100000185746 [0,1,0,0,0,1|1,0,0]=3 839 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_200121576911 [0,1,0,0,0,1|1,0,0]=3 840 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccccn2 1626a_100000689936_100000185746 [0,1,0,0,0,1|2,0,0]=4 841 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_200121576911 [0,1,0,0,0,1|2,0,0]=4 842 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2cccnc2 1626a_100011232609_100000185746 [0,1,0,0,0,1|2,0,0]=4 843 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2cccnc2 240690a_100011232609_200121576911 [0,1,0,0,0,1|2,0,0]=4 844 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccncc2 1626a_100025760769_100000185746 [0,1,0,0,0,1|2,0,0]=4 845 B19R2.12918 C=CC(=O)NC(c1ccccc1)c2ccncc2 240690a_100025760769_200121576911 [0,1,0,0,0,1|2,0,0]=4 846 B19R2.12918 CC(CO)NC(c1ccccc1)c2ccccc2 2230a_100000162943_100012180447 [0,1,0,0,0,1|1,0,1]=4 847 B19R2.12918 CC(CO)NC(c1ccccc1)c2ccccc2 34a_100000162943_100012180447 [0,1,0,0,0,1|1,0,1]=4 848 B19R2.12918 CC(CO)OC(c1ccccc1)c2ccccc2 34a_100000211180_100012180447 [0,1,0,0,0,1|1,0,1]=4 849 B19R2.12918 CC(CO)OC(c1ccccc1)c2ccccc2 7a_100000211180_100012180447 [0,1,0,0,0,1|1,0,1]=4 850 B19R2.12918 CC(CO)SC(c1ccccc1)c2ccccc2 62a_100012180447_100011216954 [0,1,0,0,0,1|1,0,1]=4 851 B19R2.12918 CCC(=O)C=C(c1ccccc1)c2ccccc2 1458a_200020630570_100000210202 [0,1,0,0,0,1|1,0,1]=4 852 B19R2.12918 CCC(=O)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100000210202 [0,1,0,0,0,1|1,0,0]=3 853 B19R2.12918 CCC(=O)CP(c1ccccc1)c2ccccc2 1458a_200020607205_100000210202 [0,1,0,0,0,1|2,0,0]=4 854 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccc2 11a_100000162943_100000210414 [0,1,0,0,0,1|1,0,0]=3 855 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccc2 1626a_100000162943_100000210414 [0,1,0,0,0,1|1,0,0]=3 856 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000210414 [0,1,0,0,0,1|1,0,0]=3 857 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000210414 [0,1,0,0,0,1|1,0,0]=3 858 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccn2 11a_100000689936_100000210414 [0,1,0,0,0,1|2,0,0]=4 859 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccn2 1626a_100000689936_100000210414 [0,1,0,0,0,1|2,0,0]=4 860 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100000210414 [0,1,0,0,0,1|2,0,0]=4 861 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccccn2 527a_100000689936_100000210414 [0,1,0,0,0,1|2,0,0]=4 862 B19R2.12918 CCC(=O)NC(c1ccccc1)c2cccnc2 11a_100011232609_100000210414 [0,1,0,0,0,1|2,0,0]=4 863 B19R2.12918 CCC(=O)NC(c1ccccc1)c2cccnc2 1626a_100011232609_100000210414 [0,1,0,0,0,1|2,0,0]=4 864 B19R2.12918 CCC(=O)NC(c1ccccc1)c2cccnc2 240690a_100011232609_100000210414 [0,1,0,0,0,1|2,0,0]=4 865 B19R2.12918 CCC(=O)NC(c1ccccc1)c2cccnc2 527a_100011232609_100000210414 [0,1,0,0,0,1|2,0,0]=4 866 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccncc2 11a_100025760769_100000210414 [0,1,0,0,0,1|2,0,0]=4 867 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccncc2 1626a_100025760769_100000210414 [0,1,0,0,0,1|2,0,0]=4 868 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccncc2 240690a_100025760769_100000210414 [0,1,0,0,0,1|2,0,0]=4 869 B19R2.12918 CCC(=O)NC(c1ccccc1)c2ccncc2 527a_100025760769_100000210414 [0,1,0,0,0,1|2,0,0]=4 870 B19R2.12918 CNC(=O)C=C(c1ccccc1)c2ccccc2 11a_106832991635_200020630570 [0,1,0,0,0,1|1,0,1]=4 871 B19R2.12918 CNC(=O)C=C(c1ccccc1)c2ccccc2 1626a_100102657272_200020630570 [0,1,0,0,0,1|1,0,1]=4 872 B19R2.12918 CNC(=O)C=C(c1ccccc1)c2ccccc2 240690a_100102657272_200020630570 [0,1,0,0,0,1|1,0,1]=4 873 B19R2.12918 CNC(=O)CC(c1ccccc1)c2ccccc2 11a_106832991635_100000499737 [0,1,0,0,0,1|1,0,0]=3 874 B19R2.12918 CNC(=O)CC(c1ccccc1)c2ccccc2 1626a_100102657272_100000499737 [0,1,0,0,0,1|1,0,0]=3 875 B19R2.12918 CNC(=O)CC(c1ccccc1)c2ccccc2 240690a_100102657272_100000499737 [0,1,0,0,0,1|1,0,0]=3 876 B19R2.12918 CNC(=O)CC(c1ccccc1)c2ccccc2 527a_100102657272_100000499737 [0,1,0,0,0,1|1,0,0]=3 877 B19R2.12918 CNC(=O)CP(c1ccccc1)c2ccccc2 11a_106832991635_200020607205 [0,1,0,0,0,1|2,0,0]=4 878 B19R2.12918 CNC(=O)CP(c1ccccc1)c2ccccc2 1626a_100102657272_200020607205 [0,1,0,0,0,1|2,0,0]=4 879 B19R2.12918 CNC(=O)CP(c1ccccc1)c2ccccc2 240690a_100102657272_200020607205 [0,1,0,0,0,1|2,0,0]=4 880 B19R2.12918 CNC(=O)CP(c1ccccc1)c2ccccc2 527a_100102657272_200020607205 [0,1,0,0,0,1|2,0,0]=4 881 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccc2 2708a_100102657272_100000162943 [0,1,0,0,0,1|1,0,0]=3 882 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccc2 273464a_100102657272_100000162943 [0,1,0,0,0,1|1,0,0]=3 883 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccc2 512a_106832991638_100000162943 [0,1,0,0,0,1|1,0,0]=3 884 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccn2 2708a_100102657272_100000689936 [0,1,0,0,0,1|2,0,0]=4 885 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccn2 273464a_100102657272_100000689936 [0,1,0,0,0,1|2,0,0]=4 886 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccccn2 512a_106832991638_100000689936 [0,1,0,0,0,1|2,0,0]=4 887 B19R2.12918 CNC(=O)NC(c1ccccc1)c2cccnc2 2708a_100102657272_100011232609 [0,1,0,0,0,1|2,0,0]=4 888 B19R2.12918 CNC(=O)NC(c1ccccc1)c2cccnc2 273464a_100102657272_100011232609 [0,1,0,0,0,1|2,0,0]=4 889 B19R2.12918 CNC(=O)NC(c1ccccc1)c2cccnc2 512a_106832991638_100011232609 [0,1,0,0,0,1|2,0,0]=4 890 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccncc2 2708a_100102657272_100025760769 [0,1,0,0,0,1|2,0,0]=4 891 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccncc2 273464a_100102657272_100025760769 [0,1,0,0,0,1|2,0,0]=4 892 B19R2.12918 CNC(=O)NC(c1ccccc1)c2ccncc2 512a_106832991638_100025760769 [0,1,0,0,0,1|2,0,0]=4 893 B19R2.12918 COC(C)SC(c1ccccc1)c2ccccc2 62a_100000211591_100009879195 [0,1,0,0,0,1|1,0,1]=4 894 B19R2.12918 COC(C)SC(c1ccccc1)c2ccccc2 62a_100009879195_100011216954 [0,1,0,0,0,1|1,0,1]=4 895 B19R2.12918 C[C@H](CO)NC(c1ccccc1)c2ccccc2 2230a_100000737577_100000211591 [0,1,0,0,0,1|1,0,1]=4 896 B19R2.12918 C[C@H](CO)NC(c1ccccc1)c2ccccc2 270004a_100000737577_100000210122 [0,1,0,0,0,1|1,0,1]=4 897 B19R2.12918 C[C@H](CO)SC(c1ccccc1)c2ccccc2 62a_100000211591_100016084084 [0,1,0,0,0,1|1,0,1]=4 898 B19R2.12918 C[C@H](CO)SC(c1ccccc1)c2ccccc2 62a_100016084084_100011216954 [0,1,0,0,0,1|1,0,1]=4 899 B19R2.12918 O=C(C=C(c1ccccc1)c2ccccc2)CF 1458a_200020630570_100015361967 [0,1,0,0,0,1|1,0,1]=4 900 B19R2.12918 O=C(CF)CC(c1ccccc1)c2ccccc2 1458a_100000499737_100015361967 [0,1,0,0,0,1|1,0,0]=3 901 B19R2.12918 O=C(CF)CP(c1ccccc1)c2ccccc2 1458a_200020607205_100015361967 [0,1,0,0,0,1|2,0,0]=4 902 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccccc2 240690a_100000162943_100000210174 [0,1,0,0,0,1|0,0,0]=2 903 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccccc2 527a_100000162943_100000210174 [0,1,0,0,0,1|0,0,0]=2 904 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccccn2 240690a_100000689936_100000210174 [0,1,0,0,0,1|1,0,0]=3 905 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccccn2 527a_100000689936_100000210174 [0,1,0,0,0,1|1,0,0]=3 906 B19R2.12918 O=C(CO)NC(c1ccccc1)c2cccnc2 240690a_100011232609_100000210174 [0,1,0,0,0,1|1,0,0]=3 907 B19R2.12918 O=C(CO)NC(c1ccccc1)c2cccnc2 527a_100011232609_100000210174 [0,1,0,0,0,1|1,0,0]=3 908 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccncc2 240690a_100025760769_100000210174 [0,1,0,0,0,1|1,0,0]=3 909 B19R2.12918 O=C(CO)NC(c1ccccc1)c2ccncc2 527a_100025760769_100000210174 [0,1,0,0,0,1|1,0,0]=3 910 B19R2.12918 O=C(CO)NC(c1ccccn1)c2ccccn2 240690a_100009954364_100000210174 [0,1,0,0,0,1|2,0,0]=4 911 B19R2.12918 O=C(CO)NC(c1ccccn1)c2ccccn2 527a_100009954364_100000210174 [0,1,0,0,0,1|2,0,0]=4 912 B19R2.13518 CC(=O)CP(=O)(c1ccccc1)c2ccccc2 1458a_200014065519_200000210301 [0,1,0,0,0,1|2,0,0]=4 913 B19R2.13518 [13CH3]C(=O)CP(=O)(c1ccccc1)c2ccccc2 1458a_200014065519_200025704644 [0,1,0,0,0,1|2,0,0]=4 914 B19R2.20629 CS(=O)(=O)NC(c1ccccc1)c2ccccc2 40a_100000162943_100000738038 [0,1,0,0,0,1|1,0,1]=4 915 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Br 11a_100011212009_100015343762 [0,1,0,0,0,1|1,0,0]=3 916 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Br 1626a_100011212009_100015343762 [0,1,0,0,0,1|1,0,0]=3 917 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Br 240690a_100011212009_100015343762 [0,1,0,0,0,1|1,0,0]=3 918 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Br 527a_100011212009_100103153847 [0,1,0,0,0,1|1,0,0]=3 919 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 11a_100000741085_100015343762 [0,1,0,0,0,1|1,0,0]=3 920 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 1626a_100000741085_100015343762 [0,1,0,0,0,1|1,0,0]=3 921 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 240690a_100000741085_100015343762 [0,1,0,0,0,1|1,0,0]=3 922 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)Cl 527a_100000741085_100103153847 [0,1,0,0,0,1|1,0,0]=3 923 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)F 11a_100000686443_100015343762 [0,1,0,0,0,1|1,0,0]=3 924 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)F 1626a_100000686443_100015343762 [0,1,0,0,0,1|1,0,0]=3 925 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)F 240690a_100000686443_100015343762 [0,1,0,0,0,1|1,0,0]=3 926 B19R2.47904 CC(=O)NC(c1ccccc1)c2cccc(c2)F 527a_100000686443_100103153847 [0,1,0,0,0,1|1,0,0]=3 927 B19R2.113616 C=C(C)C(=O)C(c1ccccc1)c2ccccc2 1458a_100000185857_100011216954 [0,1,0,0,0,1|2,0,0]=4 928 B19R2.113616 CC(=O)N(C)C(c1ccccc1)c2ccccc2 11a_100103148541_100015343762 [0,1,0,0,0,1|1,0,0]=3 929 B19R2.113616 CC(=O)N(C)C(c1ccccc1)c2ccccc2 1626a_100103148541_100015343762 [0,1,0,0,0,1|1,0,0]=3 930 B19R2.113616 CC(=O)N(C)C(c1ccccc1)c2ccccc2 240690a_100103148541_100015343762 [0,1,0,0,0,1|1,0,0]=3 931 B19R2.113616 C[C@@H](O)C(=O)C(c1ccccc1)c2ccccc2 1458a_100000717761_100011216954 [0,1,0,0,0,1|1,0,1]=4 932 B19R2.113616 C[C@H](O)C(=O)C(c1ccccc1)c2ccccc2 1458a_217856618621_100011216954 [0,1,0,0,0,1|1,0,1]=4 933 B19R2.113616 O=C(C(O)O)C(c1ccccc1)c2ccccc2 1458a_100000233687_100011216954 [0,1,0,0,0,1|0,0,2]=4 934 B19R2.9813 C#CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000184674 [0,2,0,0,0,0|1,0,0]=3 935 B19R2.9813 C#CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100011220946_100011216954 [0,2,0,0,0,0|1,0,0]=3 936 B19R2.9813 C=CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210193_100011216954 [0,2,0,0,0,0|1,0,0]=3 937 B19R2.9813 C=CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210623 [0,2,0,0,0,0|1,0,0]=3 938 B19R2.9813 CC#CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000763181_100011216954 [0,2,0,0,0,0|1,0,0]=3 939 B19R2.9813 CC=CC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210699_100011216954 [0,2,0,0,0,0|1,0,0]=3 940 B19R2.9813 CCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000210303 [0,2,0,0,0,0|1,0,0]=3 941 B19R2.9813 CCCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000211992_100011216954 [0,2,0,0,0,0|1,0,0]=3 942 B19R2.9813 CCNC(=O)C(c1ccccc1)c2ccccc2 11a_100015525214_100000210944 [0,2,0,0,0,0|1,0,0]=3 943 B19R2.9813 CCNC(=O)C(c1ccccc1)c2ccccc2 240690a_100015525214_100000210944 [0,2,0,0,0,0|1,0,0]=3 944 B19R2.9813 CCNC(=O)C(c1ccccc1)c2ccccc2 527a_100015525214_100000210944 [0,2,0,0,0,0|1,0,0]=3 945 B19R2.9813 CN(CC=O)C(c1ccccc1)c2ccccc2 2230a_100103148541_200015260668 [0,2,0,0,0,0|2,0,0]=4 946 B19R2.9813 CN(CC=O)C(c1ccccc1)c2ccccc2 269982a_100103148541_200015260668 [0,2,0,0,0,0|2,0,0]=4 947 B19R2.9813 CN(CCO)C(c1ccccc1)c2ccccc2 2230a_100000210263_100000211591 [0,2,0,0,0,0|2,0,0]=4 948 B19R2.9813 CN(CCO)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000211926 [0,2,0,0,0,0|2,0,0]=4 949 B19R2.9813 CN(CCO)C(c1ccccc1)c2ccccc2 269982a_100000210263_100000211591 [0,2,0,0,0,0|2,0,0]=4 950 B19R2.9813 CN(CCO)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000211926 [0,2,0,0,0,0|2,0,0]=4 951 B19R2.9813 CN(CCO)C(c1ccccc1)c2ccccc2 270004a_100000210263_100000210122 [0,2,0,0,0,0|2,0,0]=4 952 B19R2.9813 CNCC(=O)N(c1ccccc1)c2ccccc2 2230a_100015202596_200000210301 [0,2,0,0,0,0|2,0,0]=4 953 B19R2.9813 CNCC(=O)N(c1ccccc1)c2ccccc2 2230a_106832991635_200015198546 [0,2,0,0,0,0|2,0,0]=4 954 B19R2.9813 CNCC(=O)N(c1ccccc1)c2ccccc2 7a_106832991635_200015198546 [0,2,0,0,0,0|2,0,0]=4 955 B19R2.9813 CNNC(=O)C(c1ccccc1)c2ccccc2 22a_100016993582_100000210944 [0,2,0,0,0,0|1,0,0]=3 956 B19R2.9813 COCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210968_100011216954 [0,2,0,0,0,0|0,0,0]=2 957 B19R2.9813 COCN(C)C(c1ccccc1)c2ccccc2 2230a_100103148541_100000766300 [0,2,0,0,0,0|2,0,0]=4 958 B19R2.9813 COCN(C)C(c1ccccc1)c2ccccc2 269982a_100103148541_100000766300 [0,2,0,0,0,0|2,0,0]=4 959 B19R2.9813 CSCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000184570_100011216954 [0,2,0,0,0,0|0,1,0]=3 960 B19R2.9813 N#CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100000210944_100011214920 [0,2,0,0,0,0|1,0,0]=3 961 B19R2.9813 N#CCC(=O)C(c1ccccc1)c2ccccc2 1458a_100051588842_100011216954 [0,2,0,0,0,0|1,0,0]=3 962 B19R2.9813 O=C(C=CBr)C(c1ccccc1)c2ccccc2 1458a_100016273825_100011216954 [0,2,0,0,0,0|1,0,0]=3 963 B19R2.9813 O=C(C=CCl)C(c1ccccc1)c2ccccc2 1458a_200016279998_100011216954 [0,2,0,0,0,0|1,0,0]=3 964 B19R2.9813 O=C(C=CI)C(c1ccccc1)c2ccccc2 1458a_100016256311_100011216954 [0,2,0,0,0,0|1,0,0]=3 965 B19R2.9813 O=C(CCF)C(c1ccccc1)c2ccccc2 1458a_100000210944_100011217306 [0,2,0,0,0,0|1,0,0]=3 966 B19R2.9813 O=C(CCO)C(c1ccccc1)c2ccccc2 1458a_100000210944_100000211926 [0,2,0,0,0,0|0,0,0]=2 967 B19R2.9813 O=C(CCO)C(c1ccccc1)c2ccccc2 1458a_100011216618_100011216954 [0,2,0,0,0,0|0,0,0]=2 968 B19R2.9813 [13CH3]NCC(=O)N(c1ccccc1)c2ccccc2 2230a_100015202596_200025704644 [0,2,0,0,0,0|2,0,0]=4 969 B19R2.12728 CC(C(=O)CF)(c1ccccc1)c2ccccc2 1458a_100000752439_100015361967 [0,2,0,0,0,0|1,0,0]=3 970 B19R2.12728 CCC(=O)C(C)(c1ccccc1)c2ccccc2 1458a_100000752439_100000210202 [0,2,0,0,0,0|1,0,0]=3 971 B19R2.12728 CNC(=O)C(C)(c1ccccc1)c2ccccc2 11a_106832991635_100000752439 [0,2,0,0,0,0|1,0,0]=3 972 B19R2.12728 CNC(=O)C(C)(c1ccccc1)c2ccccc2 1626a_100102657272_100000752439 [0,2,0,0,0,0|1,0,0]=3 973 B19R2.12728 CNC(=O)C(C)(c1ccccc1)c2ccccc2 240690a_100102657272_100000752439 [0,2,0,0,0,0|1,0,0]=3 974 B19R2.12728 CNC(=O)C(C)(c1ccccc1)c2ccccc2 527a_100102657272_100000752439 [0,2,0,0,0,0|1,0,0]=3 975 B19R2.12353 CC(=O)C(c1ccc(cc1)Cl)c2ccc(cc2)Cl 1458a_200016995411_200000210301 [0,2,0,0,0,0|1,0,0]=3 976 B19R2.12353 CC(=O)C(c1ccc(cc1)F)c2ccc(cc2)F 1458a_100015316173_200000210301 [0,2,0,0,0,0|1,0,0]=3 977 B19R2.12353 [13CH3]C(=O)C(c1ccc(cc1)Cl)c2ccc(cc2)Cl 1458a_200016995411_200025704644 [0,2,0,0,0,0|1,0,0]=3 978 B19R2.12353 [13CH3]C(=O)C(c1ccc(cc1)F)c2ccc(cc2)F 1458a_100015316173_200025704644 [0,2,0,0,0,0|1,0,0]=3 979 B17R3.8 c1ccc(cc1)c2c[nH]c3c2cccc3 271570a_100012356747_100000210277 [1,0,0,1,0,0|1,0,1]=4 980 B17R3.8 c1ccc(cc1)c2coc3c2cccc3 271570a_100000084643_100000210277 [1,0,0,1,0,0|0,0,1]=3 981 B17R3.8 c1ccc(cc1)c2coc3c2cccc3 271570a_100011218836_100009812202 [1,0,0,1,0,0|0,0,1]=3 982 B17R3.8 c1ccc(cc1)c2coc3c2nccc3 271570a_100011218836_100009889148 [1,0,0,1,0,0|1,0,1]=4 983 B17R3.8 c1ccc(cc1)c2csc3c2cccc3 271570a_100000038073_100000210277 [1,0,0,1,0,0|0,1,1]=4 984 B17R3.8 c1ccc(cc1)c2csc3c2cccc3 271570a_100011218836_100009813928 [1,0,0,1,0,0|0,1,1]=4 985 B17R3.8 c1ccc(nc1)c2coc3c2cccc3 271570a_100000084643_100011216584 [1,0,0,1,0,0|1,0,1]=4 986 B17R3.8 c1ccc(nc1)c2coc3c2cccc3 271570a_100011264011_100009812202 [1,0,0,1,0,0|1,0,1]=4 987 B17R3.8 c1ccc2c(coc2c1)c3ccncc3 271570a_100000084643_100000035832 [1,0,0,1,0,0|1,0,1]=4 988 B17R3.8 c1ccc2c(coc2c1)c3ccncc3 271570a_100000752145_100009812202 [1,0,0,1,0,0|1,0,1]=4 989 B17R3.8 c1cncc(c1)c2coc3c2cccc3 271570a_100000084643_100000752921 [1,0,0,1,0,0|1,0,1]=4 990 B17R3.8 c1cncc(c1)c2coc3c2cccc3 271570a_100000757648_100009812202 [1,0,0,1,0,0|1,0,1]=4 991 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 2230a_100000104097_200000210301 [1,0,0,1,0,0|2,0,0]=4 992 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 2230a_106832991635_100000211598 [1,0,0,1,0,0|2,0,0]=4 993 B17R3.182920 CNC1c2ccccc2-c3c1cccc3 7a_106832991635_100000211598 [1,0,0,1,0,0|2,0,0]=4 994 B17R3.182920 COC1c2ccccc2-c3c1cccc3 7a_100000211495_200000210301 [1,0,0,1,0,0|2,0,0]=4 995 B17R3.182920 CSC1c2ccccc2-c3c1cccc3 62a_100000211598_200000210301 [1,0,0,1,0,0|2,0,0]=4 996 B17R3.182920 [13CH3]NC1c2ccccc2-c3c1cccc3 2230a_100000104097_200025704644 [1,0,0,1,0,0|2,0,0]=4 997 B17R3.182920 [13CH3]OC1c2ccccc2-c3c1cccc3 7a_100000211495_200025704644 [1,0,0,1,0,0|2,0,0]=4 998 B17R3.182920 [13CH3]SC1c2ccccc2-c3c1cccc3 62a_100000211598_200025704644 [1,0,0,1,0,0|2,0,0]=4 999 B19R3.288 Cc1oc2ccccc2c1Sc3ccccc3 62a_100000719477_200010236113 [0,0,0,1,0,1|1,0,1]=4 1000 B19R3.288 O=C1Nc2ccccc2C1Sc3ccccc3 62a_100000719477_200009996675 [0,0,0,1,0,1|1,0,0]=3 1001 B19R3.288 O=C1Nc2ccccc2C1Sc3ccccn3 62a_100011216584_200009996675 [0,0,0,1,0,1|2,0,0]=4 1002 B19R3.288 O=C1Nc2ccccc2C1Sc3cccnc3 62a_100000210063_200009996675 [0,0,0,1,0,1|2,0,0]=4 1003 B19R3.288 O=C1Nc2ccccc2C1Sc3ccncc3 62a_100000728582_200009996675 [0,0,0,1,0,1|2,0,0]=4 1004 B19R3.291 O=c1oc2ccccc2cc1c3ccccc3 271570a_100011218836_200000187772 [0,0,0,1,0,1|0,0,1]=3 1005 B19R3.291 O=c1oc2ccccc2cc1c3ccccn3 271570a_100011264011_200000187772 [0,0,0,1,0,1|1,0,1]=4 1006 B19R3.291 O=c1oc2ccccc2cc1c3cccnc3 271570a_100000757648_200000187772 [0,0,0,1,0,1|1,0,1]=4 1007 B19R3.291 O=c1oc2ccccc2cc1c3ccncc3 271570a_100000752145_200000187772 [0,0,0,1,0,1|1,0,1]=4 1008 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_100009888625_100000210277 [0,0,0,1,0,1|1,0,1]=4 1009 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_100011218836_100009817189 [0,0,0,1,0,1|1,0,1]=4 1010 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_203496583355_200102591465 [0,0,0,1,0,1|1,0,1]=4 1011 B19R3.291 Oc1cc2ccccc2nc1c3ccccc3 271570a_100011218836_200000100762 [0,0,0,1,0,1|1,0,1]=4 1012 B19R3.291 Oc1nc2ccccc2cc1c3ccccc3 271570a_100011218836_200009820883 [0,0,0,1,0,1|1,0,1]=4 1013 B19R3.291 Oc1nc2ccccc2cc1c3ccccc3 271570a_203496583355_100015267906 [0,0,0,1,0,1|1,0,1]=4 1014 B19R3.291 Oc1nc2ccccc2nc1c3ccccc3 271570a_203496583355_100016999723 [0,0,0,1,0,1|1,0,1]=4 1015 B19R3.657184 CC(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200000210301 [0,0,0,1,0,1|1,0,1]=4 1016 B19R3.657184 [13CH3]C(=O)c1cc2ccccc2c3c1cccc3 1458a_100020586880_200025704644 [0,0,0,1,0,1|1,0,1]=4 1017 B19R3.294 O=c1cc(c2ccccc2[nH]1)c3ccccc3 271570a_100011218836_100000075698 [0,0,0,1,0,1|1,0,1]=4 1018 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_100011218836_100010001680 [0,0,0,1,0,1|1,0,1]=4 1019 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_100020673302_100000210277 [0,0,0,1,0,1|1,0,1]=4 1020 B19R3.294 Oc1cc(c2ccccc2c1)c3ccccc3 271570a_203496583355_100025706654 [0,0,0,1,0,1|1,0,1]=4 1021 B19R3.294 Oc1cc(c2ccccc2n1)c3ccccc3 271570a_203496583355_200000716144 [0,0,0,1,0,1|1,0,1]=4 1022 B19R3.631815 CC(=O)C=C1c2ccccc2-c3c1cccc3 1458a_200000010575_200000210301 [0,0,0,1,0,1|1,0,1]=4 1023 B19R3.631815 CC(=O)CC1c2ccccc2-c3c1cccc3 1458a_100000011082_200000210301 [0,0,0,1,0,1|1,0,0]=3 1024 B19R3.631815 CC(=O)Cn1c2ccccc2c3c1cccc3 1458a_100000293892_200000210301 [0,0,0,1,0,1|2,0,0]=4 1025 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 11a_100000104097_100015343762 [0,0,0,1,0,1|1,0,0]=3 1026 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 1626a_100000104097_100015343762 [0,0,0,1,0,1|1,0,0]=3 1027 B19R3.631815 CC(=O)NC1c2ccccc2-c3c1cccc3 240690a_100000104097_100015343762 [0,0,0,1,0,1|1,0,0]=3 1028 B19R3.631815 [13CH3]C(=O)C=C1c2ccccc2-c3c1cccc3 1458a_200000010575_200025704644 [0,0,0,1,0,1|1,0,1]=4 1029 B19R3.631815 [13CH3]C(=O)CC1c2ccccc2-c3c1cccc3 1458a_100000011082_200025704644 [0,0,0,1,0,1|1,0,0]=3 1030 B19R3.631815 [13CH3]C(=O)Cn1c2ccccc2c3c1cccc3 1458a_100000293892_200025704644 [0,0,0,1,0,1|2,0,0]=4 1031 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_100011218836_100000183829 [0,1,0,1,0,0|1,0,1]=4 1032 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_200000093147_100000210277 [0,1,0,1,0,0|1,0,1]=4 1033 B19R3.346 Oc1ccc2ccccc2c1c3ccccc3 271570a_203496583355_100020644368 [0,1,0,1,0,0|1,0,1]=4 1034 B19R3.517 O=Cc1sc2ccccc2c1c3ccccc3 271570a_100011218836_100009816528 [0,1,0,1,0,0|0,1,1]=4 1035 B19R3.995546 CCC(=O)C1c2ccccc2-c3c1cccc3 1458a_100000182576_100000210202 [0,1,0,1,0,0|1,0,0]=3 1036 B19R3.995546 CNC(=O)C1c2ccccc2-c3c1cccc3 1626a_100102657272_100000182576 [0,1,0,1,0,0|1,0,0]=3 1037 B19R3.995546 CNC(=O)C1c2ccccc2-c3c1cccc3 240690a_100102657272_100000182576 [0,1,0,1,0,0|1,0,0]=3 1038 B19R3.995546 CO[C@H](C)C1c2ccccc2-c3c1cccc3 34a_200102646376_200000210301 [0,1,0,1,0,0|1,0,1]=4 1039 B19R3.995546 CO[C@H](C)C1c2ccccc2-c3c1cccc3 7a_200102646376_200000210301 [0,1,0,1,0,0|1,0,1]=4 1040 B19R3.995546 C[C@@H](O[13CH3])C1c2ccccc2-c3c1cccc3 34a_200102646376_200025704644 [0,1,0,1,0,0|1,0,1]=4 1041 B19R3.995546 C[C@@H](O[13CH3])C1c2ccccc2-c3c1cccc3 7a_200102646376_200025704644 [0,1,0,1,0,0|1,0,1]=4 1042 B19R3.995546 O=C(CF)C1c2ccccc2-c3c1cccc3 1458a_100000182576_100015361967 [0,1,0,1,0,0|1,0,0]=3 1043 B19R3.80056 Cc1ccccc1c2c(oc3c2cccc3)C 271570a_100000747142_200010236113 [0,1,0,1,0,0|1,0,1]=4 1044 B19R3.80056 Cc1oc2ccccc2c1c3ccccc3F 271570a_100000761933_200010236113 [0,1,0,1,0,0|1,0,1]=4 1045 B19R3.80056 Cc1oc2ccccc2c1c3ccccc3N 271570a_100000034411_200010236113 [0,1,0,1,0,0|1,0,1]=4 1046 B19R3.80056 Cc1oc2ccccc2c1c3ccccc3O 271570a_100000035170_200010236113 [0,1,0,1,0,0|1,0,1]=4 1047 B19R3.629728 CC(=O)C1c2ccccc2Cc3c1cccc3 1458a_200020600205_200000210301 [0,1,0,1,0,0|1,0,0]=3 1048 B19R3.629728 CC(=O)C1c2ccccc2Oc3c1cccc3 1458a_100000499733_200000210301 [0,1,0,1,0,0|1,0,0]=3 1049 B19R3.629728 CC(=O)c1c2ccccc2cc3c1cccc3 1458a_100000610644_200000210301 [0,1,0,1,0,0|1,0,1]=4 1050 B19R3.629728 [13CH3]C(=O)C1c2ccccc2Cc3c1cccc3 1458a_200020600205_200025704644 [0,1,0,1,0,0|1,0,0]=3 1051 B19R3.629728 [13CH3]C(=O)C1c2ccccc2Oc3c1cccc3 1458a_100000499733_200025704644 [0,1,0,1,0,0|1,0,0]=3 1052 B19R3.629728 [13CH3]C(=O)c1c2ccccc2cc3c1cccc3 1458a_100000610644_200025704644 [0,1,0,1,0,0|1,0,1]=4 1053 B19R3.665391 CC(=O)C1(c2ccccc2-c3c1cccc3)C 1458a_100015183572_200000210301 [0,1,0,1,0,0|1,0,0]=3 1054 B19R3.665391 CC(=O)C1(c2ccccc2-c3c1cccc3)O 1458a_100000056426_200000210301 [0,1,0,1,0,0|1,0,0]=3 1055 B19R3.665391 CC1(c2ccccc2-c3c1cccc3)C(=O)[13CH3] 1458a_100015183572_200025704644 [0,1,0,1,0,0|1,0,0]=3 1056 B19R3.665391 [13CH3]C(=O)C1(c2ccccc2-c3c1cccc3)O 1458a_100000056426_200025704644 [0,1,0,1,0,0|1,0,0]=3 1057 B19R3.52421 Cc1ccc(cc1)c2c(oc3c2cccc3)C 271570a_100000708704_200010236113 [0,1,0,1,0,0|1,0,1]=4 1058 B19R3.52421 Cc1oc2ccccc2c1c3ccc(cc3)F 271570a_100011934326_200010236113 [0,1,0,1,0,0|1,0,1]=4 1059 B19R3.52421 Cc1oc2ccccc2c1c3ccc(cc3)N 271570a_100015188457_200010236113 [0,1,0,1,0,0|1,0,1]=4 1060 B19R3.52421 Cc1oc2ccccc2c1c3ccc(cc3)O 271570a_100015205159_200010236113 [0,1,0,1,0,0|1,0,1]=4 1061 B19R3.54406 Cc1cccc(c1)c2c(oc3c2cccc3)C 271570a_100000749446_200010236113 [0,1,0,1,0,0|1,0,1]=4 1062 B19R3.54406 Cc1oc2ccccc2c1c3cccc(c3)F 271570a_100012349223_200010236113 [0,1,0,1,0,0|1,0,1]=4 1063 B19R3.54406 Cc1oc2ccccc2c1c3cccc(c3)N 271570a_100000699968_200010236113 [0,1,0,1,0,0|1,0,1]=4 1064 B19R3.54406 Cc1oc2ccccc2c1c3cccc(c3)O 271570a_100000693801_200010236113 [0,1,0,1,0,0|1,0,1]=4 1065 B17R2.162 C=CC(Sc1ccccc1)c2ccccc2 62a_100000719477_200000085779 [1,0,0,0,0,1|1,0,0]=3 1066 B17R2.162 C=CC(Sc1ccccc1)c2ccccc2 62a_200000085779_100000041952 [1,0,0,0,0,1|1,0,0]=3 1067 B17R2.162 C=CC(Sc1ccccn1)c2ccccc2 62a_100011216584_200000085779 [1,0,0,0,0,1|2,0,0]=4 1068 B17R2.162 C=CC(Sc1ccccn1)c2ccccc2 62a_200000085779_100011216584 [1,0,0,0,0,1|2,0,0]=4 1069 B17R2.162 C=CC(Sc1cccnc1)c2ccccc2 62a_100000210063_200000085779 [1,0,0,0,0,1|2,0,0]=4 1070 B17R2.162 C=CC(Sc1cccnc1)c2ccccc2 62a_200000085779_100000210063 [1,0,0,0,0,1|2,0,0]=4 1071 B17R2.162 C=CC(Sc1ccncc1)c2ccccc2 62a_100000728582_200000085779 [1,0,0,0,0,1|2,0,0]=4 1072 B17R2.162 C=CC(Sc1ccncc1)c2ccccc2 62a_200000085779_100000728582 [1,0,0,0,0,1|2,0,0]=4 1073 B17R2.162 CNC(Cc1ccccc1)c2ccccc2 2230a_100025772854_200000210301 [1,0,0,0,0,1|2,0,0]=4 1074 B17R2.162 COC(Cc1ccccc1)c2ccccc2 34a_100000246494_200000210301 [1,0,0,0,0,1|2,0,0]=4 1075 B17R2.162 COC(Cc1ccccc1)c2ccccc2 7a_100000246494_200000210301 [1,0,0,0,0,1|2,0,0]=4 1076 B17R2.162 [13CH3]NC(Cc1ccccc1)c2ccccc2 2230a_100025772854_200025704644 [1,0,0,0,0,1|2,0,0]=4 1077 B17R2.162 [13CH3]OC(Cc1ccccc1)c2ccccc2 34a_100000246494_200025704644 [1,0,0,0,0,1|2,0,0]=4 1078 B17R2.162 [13CH3]OC(Cc1ccccc1)c2ccccc2 7a_100000246494_200025704644 [1,0,0,0,0,1|2,0,0]=4 1079 B17R2.3542 CC(=O)C(Cc1ccccc1)n2cccc2 1458a_100000243807_200000210301 [0,0,0,0,1,1|2,0,0]=4 1080 B17R2.3542 [13CH3]C(=O)C(Cc1ccccc1)n2cccc2 1458a_100000243807_200025704644 [0,0,0,0,1,1|2,0,0]=4 1081 B17R2.5712 CC(=O)CC(c1ccccc1)c2ccco2 1458a_100000067043_200000210301 [0,0,0,0,1,1|2,0,0]=4 1082 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccco2 11a_100015185865_100015343762 [0,0,0,0,1,1|2,0,0]=4 1083 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccco2 1626a_100015185865_100015343762 [0,0,0,0,1,1|2,0,0]=4 1084 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccco2 240690a_100015185865_100015343762 [0,0,0,0,1,1|2,0,0]=4 1085 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccco2 527a_100015185865_100103153847 [0,0,0,0,1,1|2,0,0]=4 1086 B17R2.5712 CC(=O)NC(c1ccccc1)c2cccs2 11a_100025760362_100015343762 [0,0,0,0,1,1|2,0,0]=4 1087 B17R2.5712 CC(=O)NC(c1ccccc1)c2cccs2 1626a_100025760362_100015343762 [0,0,0,0,1,1|2,0,0]=4 1088 B17R2.5712 CC(=O)NC(c1ccccc1)c2cccs2 240690a_100025760362_100015343762 [0,0,0,0,1,1|2,0,0]=4 1089 B17R2.5712 CC(=O)NC(c1ccccc1)c2cccs2 527a_100025760362_100103153847 [0,0,0,0,1,1|2,0,0]=4 1090 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccoc2 11a_100102946537_100015343762 [0,0,0,0,1,1|2,0,0]=4 1091 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccoc2 1626a_100102946537_100015343762 [0,0,0,0,1,1|2,0,0]=4 1092 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccoc2 240690a_100102946537_100015343762 [0,0,0,0,1,1|2,0,0]=4 1093 B17R2.5712 CC(=O)NC(c1ccccc1)c2ccoc2 527a_100102946537_100103153847 [0,0,0,0,1,1|2,0,0]=4 1094 B17R2.5712 [13CH3]C(=O)CC(c1ccccc1)c2ccco2 1458a_100000067043_200025704644 [0,0,0,0,1,1|2,0,0]=4 1095 B19R2.2540 CC(=O)NC(Cc1ccccc1)c2ccccc2 11a_100025772854_100015343762 [0,0,0,0,0,2|1,0,0]=3 1096 B19R2.2540 CC(=O)NC(Cc1ccccc1)c2ccccc2 1626a_100025772854_100015343762 [0,0,0,0,0,2|1,0,0]=3 1097 B19R2.2540 CC(=O)NC(Cc1ccccc1)c2ccccc2 240690a_100025772854_100015343762 [0,0,0,0,0,2|1,0,0]=3 1098 B19R2.2540 CC(=O)NC(Cc1ccccc1)c2ccccc2 527a_100025772854_100103153847 [0,0,0,0,0,2|1,0,0]=3 1099 B19R2.2540 NC(=O)CN(Cc1ccccc1)c2ccccc2 2230a_100000188819_100000747473 [0,0,0,0,0,2|2,0,0]=4 1100 B19R2.2540 NC(=O)CN(Cc1ccccc1)c2ccccc2 2230a_100000212578_100015291786 [0,0,0,0,0,2|2,0,0]=4 1101 B19R2.2540 NC(=O)CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100000187820 [0,0,0,0,0,2|2,0,0]=4 1102 B19R2.2540 NC(=O)CN(Cc1ccccc1)c2ccccc2 269982a_100000212578_100000211182 [0,0,0,0,0,2|2,0,0]=4 1103 B19R2.2540 NC(=O)CN(Cc1ccccc1)c2ccccc2 34a_100000188819_100000187820 [0,0,0,0,0,2|2,0,0]=4 1104 B19R2.2540 O=C(O)CN(Cc1ccccc1)c2ccccc2 269956a_100000212060_100015291786 [0,0,0,0,0,2|1,0,0]=3 1105 B19R2.2540 O=C(O)CN(Cc1ccccn1)c2ccccc2 269956a_100000212060_100000721315 [0,0,0,0,0,2|2,0,0]=4 1106 B19R2.2540 O=C(O)CN(Cc1cccnc1)c2ccccc2 269956a_100000212060_100000733263 [0,0,0,0,0,2|2,0,0]=4 1107 B19R2.2540 O=C(O)CN(Cc1ccncc1)c2ccccc2 269956a_100000212060_100015193705 [0,0,0,0,0,2|2,0,0]=4 1108 B19R2.2540 O=C([O-])CN(Cc1ccccc1)c2ccccc2 269982a_100000188819_100020667443 [0,0,0,0,0,2|1,0,1]=4 1109 B19R2.2540 O=C([O-])CN(Cc1ccccc1)c2ccccc2 34a_100000188819_100020667443 [0,0,0,0,0,2|1,0,1]=4 1110 B19R2.2541 C=C(C)C(OCc1ccccc1)c2ccccc2 34a_200011216824_100015291786 [0,0,0,0,0,2|2,0,0]=4 1111 B19R2.2541 C=C(C)C(OCc1ccccc1)c2ccccc2 7a_200011216824_100000211182 [0,0,0,0,0,2|2,0,0]=4 1112 B19R2.2541 CC(=O)C(NCc1ccccc1)c2ccccc2 2230a_100015324214_100009888967 [0,0,0,0,0,2|1,0,0]=3 1113 B19R2.2541 CC(=O)C(OCc1ccccc1)c2ccccc2 7a_100000210790_100009888967 [0,0,0,0,0,2|1,0,0]=3 1114 B19R2.2541 CC(=O)C(SCc1ccccc1)c2ccccc2 62a_100000211182_100009888967 [0,0,0,0,0,2|1,0,0]=3 1115 B19R2.2541 CC(=O)C(SCc1ccccc1)c2ccccc2 62a_100009888967_100015291786 [0,0,0,0,0,2|1,0,0]=3 1116 B19R2.2541 CC(=O)C(SCc1ccccn1)c2ccccc2 62a_100000721315_100009888967 [0,0,0,0,0,2|2,0,0]=4 1117 B19R2.2541 CC(=O)C(SCc1ccccn1)c2ccccc2 62a_100009888967_100000721315 [0,0,0,0,0,2|2,0,0]=4 1118 B19R2.2541 CC(=O)C(SCc1cccnc1)c2ccccc2 62a_100000741622_100009888967 [0,0,0,0,0,2|2,0,0]=4 1119 B19R2.2541 CC(=O)C(SCc1cccnc1)c2ccccc2 62a_100009888967_100000741622 [0,0,0,0,0,2|2,0,0]=4 1120 B19R2.2541 CC(=O)C(SCc1ccncc1)c2ccccc2 62a_100009888967_100015193705 [0,0,0,0,0,2|2,0,0]=4 1121 B19R2.2541 CC(=O)C(SCc1ccncc1)c2ccccc2 62a_100015193705_100009888967 [0,0,0,0,0,2|2,0,0]=4 1122 B19R2.2541 C[C@H](O)[C@@H](NCc1ccccc1)c2ccccc2 207a_100134616770_100015611070 [0,0,0,0,0,2|1,0,1]=4 1123 B19R2.2541 C[C@H](O)[C@@H](NCc1ccccc1)c2ccccc2 2230a_100134616770_100015291786 [0,0,0,0,0,2|1,0,1]=4 1124 B19R2.2541 C[C@H](O)[C@@H](NCc1ccccc1)c2ccccc2 270004a_100134616770_100015611070 [0,0,0,0,0,2|1,0,1]=4 1125 B19R2.2541 NC(=O)C(NCc1ccccc1)c2ccccc2 2230a_100015324214_100000188848 [0,0,0,0,0,2|1,0,0]=3 1126 B19R2.2541 NC(=O)C(OCc1ccccc1)c2ccccc2 34a_100011200849_100015291786 [0,0,0,0,0,2|1,0,0]=3 1127 B19R2.2541 NC(=O)C(OCc1ccccc1)c2ccccc2 7a_100000210790_100000188848 [0,0,0,0,0,2|1,0,0]=3 1128 B19R2.2541 NC(=O)C(OCc1ccccc1)c2ccccc2 7a_100011200849_100000211182 [0,0,0,0,0,2|1,0,0]=3 1129 B19R2.2541 NC(=O)C(OCc1ccccn1)c2ccccc2 34a_100011200849_100000721315 [0,0,0,0,0,2|2,0,0]=4 1130 B19R2.2541 NC(=O)C(OCc1ccccn1)c2ccccc2 7a_100011200849_100000721315 [0,0,0,0,0,2|2,0,0]=4 1131 B19R2.2541 NC(=O)C(OCc1cccnc1)c2ccccc2 34a_100011200849_100000733263 [0,0,0,0,0,2|2,0,0]=4 1132 B19R2.2541 NC(=O)C(OCc1cccnc1)c2ccccc2 7a_100011200849_100000741622 [0,0,0,0,0,2|2,0,0]=4 1133 B19R2.2541 NC(=O)C(OCc1ccncc1)c2ccccc2 7a_100011200849_100015193705 [0,0,0,0,0,2|2,0,0]=4 1134 B19R2.2541 NC(=O)C(SCc1ccccc1)c2ccccc2 62a_100000188848_100015291786 [0,0,0,0,0,2|1,0,0]=3 1135 B19R2.2541 NC(=O)C(SCc1ccccc1)c2ccccc2 62a_100000211182_100000188848 [0,0,0,0,0,2|1,0,0]=3 1136 B19R2.2541 NC(=O)C(SCc1ccccn1)c2ccccc2 62a_100000188848_100000721315 [0,0,0,0,0,2|2,0,0]=4 1137 B19R2.2541 NC(=O)C(SCc1ccccn1)c2ccccc2 62a_100000721315_100000188848 [0,0,0,0,0,2|2,0,0]=4 1138 B19R2.2541 NC(=O)C(SCc1cccnc1)c2ccccc2 62a_100000188848_100000741622 [0,0,0,0,0,2|2,0,0]=4 1139 B19R2.2541 NC(=O)C(SCc1cccnc1)c2ccccc2 62a_100000741622_100000188848 [0,0,0,0,0,2|2,0,0]=4 1140 B19R2.2541 NC(=O)C(SCc1ccncc1)c2ccccc2 62a_100000188848_100015193705 [0,0,0,0,0,2|2,0,0]=4 1141 B19R2.2541 NC(=O)C(SCc1ccncc1)c2ccccc2 62a_100015193705_100000188848 [0,0,0,0,0,2|2,0,0]=4 1142 B19R2.2541 NC(=O)[C@H](NCc1ccccc1)c2ccccc2 207a_100011423151_100015611070 [0,0,0,0,0,2|1,0,0]=3 1143 B19R2.2541 NC(=O)[C@H](NCc1ccccc1)c2ccccc2 2230a_100011423151_100015291786 [0,0,0,0,0,2|1,0,0]=3 1144 B19R2.2541 NC(=O)[C@H](NCc1ccccc1)c2ccccc2 270004a_100011423151_100015611070 [0,0,0,0,0,2|1,0,0]=3 1145 B19R2.2541 NC(=O)[C@H](NCc1ccccn1)c2ccccc2 207a_100011423151_100000209966 [0,0,0,0,0,2|2,0,0]=4 1146 B19R2.2541 NC(=O)[C@H](NCc1ccccn1)c2ccccc2 2230a_100011423151_100000721315 [0,0,0,0,0,2|2,0,0]=4 1147 B19R2.2541 NC(=O)[C@H](NCc1ccccn1)c2ccccc2 270004a_100011423151_100000209966 [0,0,0,0,0,2|2,0,0]=4 1148 B19R2.2541 NC(=O)[C@H](NCc1cccnc1)c2ccccc2 207a_100011423151_100000209961 [0,0,0,0,0,2|2,0,0]=4 1149 B19R2.2541 NC(=O)[C@H](NCc1cccnc1)c2ccccc2 2230a_100011423151_100000741622 [0,0,0,0,0,2|2,0,0]=4 1150 B19R2.2541 NC(=O)[C@H](NCc1cccnc1)c2ccccc2 270004a_100011423151_100000209961 [0,0,0,0,0,2|2,0,0]=4 1151 B19R2.2541 NC(=O)[C@H](NCc1ccncc1)c2ccccc2 207a_100011423151_100000186114 [0,0,0,0,0,2|2,0,0]=4 1152 B19R2.2541 NC(=O)[C@H](NCc1ccncc1)c2ccccc2 2230a_100011423151_100015193705 [0,0,0,0,0,2|2,0,0]=4 1153 B19R2.2541 O=C(O)C(NCc1ccccc1)c2ccccc2 269956a_100000230147_100015291786 [0,0,0,0,0,2|0,0,0]=2 1154 B19R2.2541 O=C(O)C(NCc1ccccc1)c2ccccn2 269956a_200016167988_100015291786 [0,0,0,0,0,2|1,0,0]=3 1155 B19R2.2541 O=C(O)C(NCc1ccccn1)c2ccccc2 269956a_100000230147_100000721315 [0,0,0,0,0,2|1,0,0]=3 1156 B19R2.2541 O=C(O)C(NCc1ccccn1)c2ccccn2 269956a_200016167988_100000721315 [0,0,0,0,0,2|2,0,0]=4 1157 B19R2.2541 O=C(O)C(NCc1cccnc1)c2ccccc2 269956a_100000230147_100000733263 [0,0,0,0,0,2|1,0,0]=3 1158 B19R2.2541 O=C(O)C(NCc1cccnc1)c2ccccn2 269956a_200016167988_100000733263 [0,0,0,0,0,2|2,0,0]=4 1159 B19R2.2541 O=C(O)C(NCc1cccnn1)c2ccccc2 269956a_100000230147_100016990269 [0,0,0,0,0,2|2,0,0]=4 1160 B19R2.2541 O=C(O)C(NCc1ccncc1)c2ccccc2 269956a_100000230147_100015193705 [0,0,0,0,0,2|1,0,0]=3 1161 B19R2.2541 O=C(O)C(NCc1ccncc1)c2ccccn2 269956a_200016167988_100015193705 [0,0,0,0,0,2|2,0,0]=4 1162 B19R2.2541 O=C(O)C(NCc1cnccn1)c2ccccc2 269956a_100000230147_100016995436 [0,0,0,0,0,2|2,0,0]=4 1163 B19R2.2541 O=C(O)C(NCc1cncnc1)c2ccccc2 269956a_100000230147_100016991940 [0,0,0,0,0,2|2,0,0]=4 1164 B19R2.2541 O=C(O)C(NCc1ncccn1)c2ccccc2 269956a_100000230147_100000703007 [0,0,0,0,0,2|2,0,0]=4 1165 B19R2.2541 O=C(O)[C@H](NCc1ccccc1)C2=CCC=CC2 269956a_100016989015_100015291786 [0,0,0,0,0,2|0,0,2]=4 1166 B19R2.4600 CC(=O)C(Cc1ccccc1)Cc2ccccc2 1458a_100000725935_200000210301 [0,0,0,0,0,2|1,0,0]=3 1167 B19R2.4600 CC(=O)N(Cc1ccccc1)Cc2ccccc2 11a_100000185734_100015343762 [0,0,0,0,0,2|2,0,0]=4 1168 B19R2.4600 CC(=O)N(Cc1ccccc1)Cc2ccccc2 1626a_100000185734_100015343762 [0,0,0,0,0,2|2,0,0]=4 1169 B19R2.4600 CC(=O)N(Cc1ccccc1)Cc2ccccc2 240690a_100000185734_100015343762 [0,0,0,0,0,2|2,0,0]=4 1170 B19R2.4600 [13CH3]C(=O)C(Cc1ccccc1)Cc2ccccc2 1458a_100000725935_200025704644 [0,0,0,0,0,2|1,0,0]=3 1171 B19R2.13577 C=C(C)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000748629 [0,0,0,0,0,2|2,0,0]=4 1172 B19R2.13577 C=C(C)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000748629 [0,0,0,0,0,2|2,0,0]=4 1173 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000748629 [0,0,0,0,0,2|2,0,0]=4 1174 B19R2.13577 C=C(C)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000748629 [0,0,0,0,0,2|2,0,0]=4 1175 B19R2.13577 C=C(F)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009893438 [0,0,0,0,0,2|2,0,0]=4 1176 B19R2.13577 C=C(F)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100009893438 [0,0,0,0,0,2|2,0,0]=4 1177 B19R2.13577 C=C(F)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009893438 [0,0,0,0,0,2|2,0,0]=4 1178 B19R2.13577 C=C(F)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000042424 [0,0,0,0,0,2|2,0,0]=4 1179 B19R2.13577 C=C(F)CSC(c1ccccc1)c2ccccc2 62a_100000042424_100011216954 [0,0,0,0,0,2|2,0,0]=4 1180 B19R2.13577 C=C(F)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000042424 [0,0,0,0,0,2|2,0,0]=4 1181 B19R2.13577 CC(=O)CCC(c1ccccc1)c2ccccc2 1458a_100000070787_100009813428 [0,0,0,0,0,2|1,0,0]=3 1182 B19R2.13577 CC(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_200000210301 [0,0,0,0,0,2|2,0,0]=4 1183 B19R2.13577 CC(=O)CC[S+](c1ccccc1)c2ccccc2 1458a_100000070787_100010140906 [0,0,0,0,0,2|2,0,0]=4 1184 B19R2.13577 CC(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_200000210301 [0,0,0,0,0,2|1,0,0]=3 1185 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 1626a_100000739227_100015343762 [0,0,0,0,0,2|1,0,0]=3 1186 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 240690a_100000739227_100015343762 [0,0,0,0,0,2|1,0,0]=3 1187 B19R2.13577 CC(=O)NCC(c1ccccc1)c2ccccc2 527a_100000739227_100103153847 [0,0,0,0,0,2|1,0,0]=3 1188 B19R2.13577 CC(=O)NNC(c1ccccc1)c2ccccc2 22a_100000742501_100000070787 [0,0,0,0,0,2|1,0,0]=3 1189 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100011218427 [0,0,0,0,0,2|1,0,1]=4 1190 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 2230a_100000210904_100000211591 [0,0,0,0,0,2|1,0,1]=4 1191 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 270004a_100000210904_100000210122 [0,0,0,0,0,2|1,0,1]=4 1192 B19R2.13577 CC(O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100011218427 [0,0,0,0,0,2|1,0,1]=4 1193 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100011218427 [0,0,0,0,0,2|1,0,1]=4 1194 B19R2.13577 CC(O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100011218427 [0,0,0,0,0,2|1,0,1]=4 1195 B19R2.13577 CC(O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100011218427 [0,0,0,0,0,2|1,0,1]=4 1196 B19R2.13577 CC(O)CSC(c1ccccc1)c2ccccc2 62a_100011218427_100011216954 [0,0,0,0,0,2|1,0,1]=4 1197 B19R2.13577 C[C@@H](O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100009817552 [0,0,0,0,0,2|1,0,1]=4 1198 B19R2.13577 C[C@@H](O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100009817552 [0,0,0,0,0,2|1,0,1]=4 1199 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100009817552 [0,0,0,0,0,2|1,0,1]=4 1200 B19R2.13577 C[C@@H](O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100009817552 [0,0,0,0,0,2|1,0,1]=4 1201 B19R2.13577 C[C@@H](O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100009817552 [0,0,0,0,0,2|1,0,1]=4 1202 B19R2.13577 C[C@@H](O)CSC(c1ccccc1)c2ccccc2 62a_100009817552_100011216954 [0,0,0,0,0,2|1,0,1]=4 1203 B19R2.13577 NC(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000162943_100000747473 [0,0,0,0,0,2|1,0,0]=3 1204 B19R2.13577 NC(=O)CNC(c1ccccc1)c2ccccc2 2230a_100000711301_100000211591 [0,0,0,0,0,2|1,0,0]=3 1205 B19R2.13577 NC(=O)CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000187820 [0,0,0,0,0,2|1,0,0]=3 1206 B19R2.13577 NC(=O)CNC(c1ccccc1)c2ccccn2 2230a_100000689936_100000747473 [0,0,0,0,0,2|2,0,0]=4 1207 B19R2.13577 NC(=O)CNC(c1ccccc1)c2cccnc2 2230a_100011232609_100000747473 [0,0,0,0,0,2|2,0,0]=4 1208 B19R2.13577 NC(=O)CNC(c1ccccc1)c2ccncc2 2230a_100025760769_100000747473 [0,0,0,0,0,2|2,0,0]=4 1209 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccc2 34a_100000211180_100000187820 [0,0,0,0,0,2|1,0,0]=3 1210 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccc2 7a_100000211180_100000187820 [0,0,0,0,0,2|1,0,0]=3 1211 B19R2.13577 NC(=O)COC(c1ccccc1)c2ccccn2 7a_100000180852_100000187820 [0,0,0,0,0,2|2,0,0]=4 1212 B19R2.13577 NC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000747473 [0,0,0,0,0,2|1,0,0]=3 1213 B19R2.13577 NC(=O)CSC(c1ccccc1)c2ccccc2 62a_100000747473_100011216954 [0,0,0,0,0,2|1,0,0]=3 1214 B19R2.13577 O=C(O)CNC(c1ccccc1)c2ccccc2 269956a_100016091260_100011216954 [0,0,0,0,0,2|0,0,0]=2 1215 B19R2.13577 O=C([O-])CNC(c1ccccc1)c2ccccc2 34a_100000162943_100020667443 [0,0,0,0,0,2|0,0,1]=3 1216 B19R2.13577 O=C([O-])COC(c1ccccc1)c2ccccc2 34a_100000211180_100020667443 [0,0,0,0,0,2|0,0,1]=3 1217 B19R2.13577 O=C([O-])CSC(c1ccccc1)c2ccccc2 62a_100000211591_100020667443 [0,0,0,0,0,2|0,0,1]=3 1218 B19R2.13577 O=C([O-])CSC(c1ccccc1)c2ccccc2 62a_100020667443_100011216954 [0,0,0,0,0,2|0,0,1]=3 1219 B19R2.13577 O=[N+]([O-])CNC(c1ccccc1)c2ccccc2 34a_100000162943_100000761209 [0,0,0,0,0,2|1,0,1]=4 1220 B19R2.13577 O=[N+]([O-])COC(c1ccccc1)c2ccccc2 34a_100000211180_100000761209 [0,0,0,0,0,2|1,0,1]=4 1221 B19R2.13577 O=[N+]([O-])CSC(c1ccccc1)c2ccccc2 62a_100000211591_100000761209 [0,0,0,0,0,2|1,0,1]=4 1222 B19R2.13577 [13CH3]C(=O)CCP(c1ccccc1)c2ccccc2 1458a_100020644332_200025704644 [0,0,0,0,0,2|2,0,0]=4 1223 B19R2.13577 [13CH3]C(=O)CSC(c1ccccc1)c2ccccc2 1458a_100000683935_200025704644 [0,0,0,0,0,2|1,0,0]=3