0 B19R3.6049 O=C1c2ccccc2C(=O)C1N3CC=CCC3 2230a_100000698166_200009813996 [0,0,0,0,0,0|1,0,3]=4 1 B19R3.6049 O=C1c2ccccc2C(=O)C1N3CC=CCC3 269982a_100000698166_200009813996 [0,0,0,0,0,0|1,0,3]=4 2 B18R3.111 Cc1c(oc2c1cccc2)c3ccccc3 271570a_100009874717_100000210277 [1,0,0,0,0,0|2,0,1]=4 3 B18R3.111 Cc1c(sc2c1cccc2)c3ccccc3 271570a_100011218836_200010198769 [1,0,0,0,0,0|2,0,1]=4 4 B18R3.111 Cn1c(cc2c1cccc2)c3ccccc3 271570a_100010171889_100000210277 [1,0,0,0,0,0|2,0,1]=4 5 B20R3.277098 O=C1c2ccc(cc2C(=O)N1c3ccccc3)O 271570a_203496583355_200103168701 [0,1,0,0,0,0|1,0,0]=2 6 B20R3.402790 O=C1c2ccccc2C(=O)N1c3ccc(cc3)O 271570a_203496583355_100000129684 [0,1,0,0,0,0|1,0,0]=2 7 B18R2.2315 C=CC(c1ccccc1)N(C)c2ccccc2 2230a_100000210012_200000085779 [0,0,1,0,0,0|3,0,0]=4 8 B18R2.2315 C=CC(c1ccccc1)N(C)c2ccccc2 269982a_100000210012_200000085779 [0,0,1,0,0,0|3,0,0]=4 9 B18R2.2315 CCN(C(=O)c1ccccc1)c2ccccc2 11a_100000210013_100000185807 [0,0,1,0,0,0|2,0,1]=4 10 B18R2.2315 CCN(C(=O)c1ccccc1)c2ccccc2 1626a_100000210013_100000185807 [0,0,1,0,0,0|2,0,1]=4 11 B18R2.2315 CCN(C(=O)c1ccccc1)c2ccccc2 22a_100000210013_100000185807 [0,0,1,0,0,0|2,0,1]=4 12 B18R2.2315 CNC(C(=O)c1ccccc1)c2ccccc2 2230a_106832991635_100000211254 [0,0,1,0,0,0|2,0,0]=3 13 B18R2.2315 CNC(C(=O)c1ccccc1)c2ccccc2 7a_106832991635_100000211254 [0,0,1,0,0,0|2,0,0]=3 14 B18R2.2315 COC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_200000210301 [0,0,1,0,0,0|2,0,0]=3 15 B18R2.2315 CSC(C(=O)c1ccccc1)c2ccccc2 62a_100000211254_200000210301 [0,0,1,0,0,0|2,0,0]=3 16 B18R2.2315 CSC(C(=O)c1ccccc1)c2ccccc2 62a_200000210301_100000211254 [0,0,1,0,0,0|2,0,0]=3 17 B18R2.2315 [13CH3]OC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_200025704644 [0,0,1,0,0,0|2,0,0]=3 18 B18R2.2315 [13CH3]SC(C(=O)c1ccccc1)c2ccccc2 62a_100000211254_200025704644 [0,0,1,0,0,0|2,0,0]=3 19 B18R2.2315 [13CH3]SC(C(=O)c1ccccc1)c2ccccc2 62a_200025704644_100000211254 [0,0,1,0,0,0|2,0,0]=3 20 B18R2.3047 C#Cc1ccccc1C(=O)Cc2ccccc2 1458a_100011243808_100015291786 [0,0,1,0,0,0|1,0,1]=3 21 B18R2.3047 C#Cc1ccccc1C(=O)Cc2ccccn2 1458a_100011243808_100000721315 [0,0,1,0,0,0|2,0,1]=4 22 B18R2.3047 C#Cc1ccccc1C(=O)Cc2cccnc2 1458a_100011243808_100000733263 [0,0,1,0,0,0|2,0,1]=4 23 B18R2.3047 C#Cc1ccccc1C(=O)Cc2ccncc2 1458a_100011243808_100000705612 [0,0,1,0,0,0|2,0,1]=4 24 B18R2.3047 C#Cc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100011243808 [0,0,1,0,0,0|2,0,1]=4 25 B18R2.3047 C#Cc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100011243808 [0,0,1,0,0,0|2,0,1]=4 26 B18R2.3047 C=Cc1ccccc1C(=O)Cc2ccccc2 1458a_100011830265_100015291786 [0,0,1,0,0,0|1,0,0]=2 27 B18R2.3047 C=Cc1ccccc1C(=O)Cc2ccccn2 1458a_100011830265_100000721315 [0,0,1,0,0,0|2,0,0]=3 28 B18R2.3047 C=Cc1ccccc1C(=O)Cc2cccnc2 1458a_100011830265_100000733263 [0,0,1,0,0,0|2,0,0]=3 29 B18R2.3047 C=Cc1ccccc1C(=O)Cc2cccnn2 1458a_100011830265_100016990269 [0,0,1,0,0,0|3,0,0]=4 30 B18R2.3047 C=Cc1ccccc1C(=O)Cc2ccncc2 1458a_100011830265_100000705612 [0,0,1,0,0,0|2,0,0]=3 31 B18R2.3047 C=Cc1ccccc1C(=O)Cc2cnccn2 1458a_100011830265_100016995436 [0,0,1,0,0,0|3,0,0]=4 32 B18R2.3047 C=Cc1ccccc1C(=O)Cc2cncnc2 1458a_100011830265_100015196519 [0,0,1,0,0,0|3,0,0]=4 33 B18R2.3047 C=Cc1ccccc1C(=O)Cc2ncccn2 1458a_100011830265_100000703007 [0,0,1,0,0,0|3,0,0]=4 34 B18R2.3047 C=Cc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100011830265 [0,0,1,0,0,0|2,0,0]=3 35 B18R2.3047 C=Cc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100011830265 [0,0,1,0,0,0|2,0,0]=3 36 B18R2.3047 C=Cc1cnccc1C(=O)Nc2ccccc2 271570a_100011290941_200016737083 [0,0,1,0,0,0|3,0,0]=4 37 B18R2.3047 CCc1ccccc1C(=O)Cc2ccccc2 1458a_100000689120_100015291786 [0,0,1,0,0,0|1,0,1]=3 38 B18R2.3047 CCc1ccccc1C(=O)Cc2ccccn2 1458a_100000689120_100000721315 [0,0,1,0,0,0|2,0,1]=4 39 B18R2.3047 CCc1ccccc1C(=O)Cc2cccnc2 1458a_100000689120_100000733263 [0,0,1,0,0,0|2,0,1]=4 40 B18R2.3047 CCc1ccccc1C(=O)Cc2ccncc2 1458a_100000689120_100000705612 [0,0,1,0,0,0|2,0,1]=4 41 B18R2.3047 CCc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000689120 [0,0,1,0,0,0|2,0,1]=4 42 B18R2.3047 CCc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000689120 [0,0,1,0,0,0|2,0,1]=4 43 B18R2.3047 CCc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000689120 [0,0,1,0,0,0|2,0,1]=4 44 B18R2.3047 CCc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000689120 [0,0,1,0,0,0|2,0,1]=4 45 B18R2.3047 CNc1ccccc1C(=O)Nc2ccccc2 34a_200005462405_200000210301 [0,0,1,0,0,0|3,0,0]=4 46 B18R2.3047 COc1ccccc1C(=O)Cc2ccccc2 1458a_100000185835_100015291786 [0,0,1,0,0,0|2,0,0]=3 47 B18R2.3047 COc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_200000210301 [0,0,1,0,0,0|2,0,0]=3 48 B18R2.3047 COc1ccccc1C(=O)Cc2ccccn2 1458a_100000185835_100000721315 [0,0,1,0,0,0|3,0,0]=4 49 B18R2.3047 COc1ccccc1C(=O)Cc2cccnc2 1458a_100000185835_100000733263 [0,0,1,0,0,0|3,0,0]=4 50 B18R2.3047 COc1ccccc1C(=O)Cc2ccncc2 1458a_100000185835_100000705612 [0,0,1,0,0,0|3,0,0]=4 51 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000185835 [0,0,1,0,0,0|3,0,0]=4 52 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000185835 [0,0,1,0,0,0|3,0,0]=4 53 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000185835 [0,0,1,0,0,0|3,0,0]=4 54 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 34a_100000263231_200000210301 [0,0,1,0,0,0|3,0,0]=4 55 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000185835 [0,0,1,0,0,0|3,0,0]=4 56 B18R2.3047 COc1ccccc1C(=O)Nc2ccccc2 7a_100000263231_200000210301 [0,0,1,0,0,0|3,0,0]=4 57 B18R2.3047 COc1ccccc1C(=O)Oc2ccccc2 7a_100005462448_200000210301 [0,0,1,0,0,0|3,0,0]=4 58 B18R2.3047 CSc1ccccc1C(=O)Cc2ccccc2 1458a_100000183967_100015291786 [0,0,1,0,0,0|2,0,0]=3 59 B18R2.3047 CSc1ccccc1C(=O)Cc2ccccn2 1458a_100000183967_100000721315 [0,0,1,0,0,0|3,0,0]=4 60 B18R2.3047 CSc1ccccc1C(=O)Cc2cccnc2 1458a_100000183967_100000733263 [0,0,1,0,0,0|3,0,0]=4 61 B18R2.3047 CSc1ccccc1C(=O)Cc2ccncc2 1458a_100000183967_100000705612 [0,0,1,0,0,0|3,0,0]=4 62 B18R2.3047 CSc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000183967 [0,0,1,0,0,0|3,0,0]=4 63 B18R2.3047 CSc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000183967 [0,0,1,0,0,0|3,0,0]=4 64 B18R2.3047 CSc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000183967 [0,0,1,0,0,0|3,0,0]=4 65 B18R2.3047 CSc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000183967 [0,0,1,0,0,0|3,0,0]=4 66 B18R2.3047 N#Cc1ccccc1C(=O)Cc2ccccc2 1458a_100000742908_100015291786 [0,0,1,0,0,0|1,0,1]=3 67 B18R2.3047 N#Cc1ccccc1C(=O)Cc2ccccn2 1458a_100000742908_100000721315 [0,0,1,0,0,0|2,0,1]=4 68 B18R2.3047 N#Cc1ccccc1C(=O)Cc2cccnc2 1458a_100000742908_100000733263 [0,0,1,0,0,0|2,0,1]=4 69 B18R2.3047 N#Cc1ccccc1C(=O)Cc2ccncc2 1458a_100000742908_100000705612 [0,0,1,0,0,0|2,0,1]=4 70 B18R2.3047 N#Cc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000742908 [0,0,1,0,0,0|2,0,1]=4 71 B18R2.3047 N#Cc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000742908 [0,0,1,0,0,0|2,0,1]=4 72 B18R2.3047 N#Cc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000742908 [0,0,1,0,0,0|2,0,1]=4 73 B18R2.3047 N#Cc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000742908 [0,0,1,0,0,0|2,0,1]=4 74 B18R2.3047 O=C(Cc1ccccc1)c2ccccc2CO 1458a_100011301526_100015291786 [0,0,1,0,0,0|0,0,2]=3 75 B18R2.3047 O=C(Cc1ccccn1)c2ccccc2CO 1458a_100011301526_100000721315 [0,0,1,0,0,0|1,0,2]=4 76 B18R2.3047 O=C(Cc1cccnc1)c2ccccc2CO 1458a_100011301526_100000733263 [0,0,1,0,0,0|1,0,2]=4 77 B18R2.3047 O=C(Cc1ccncc1)c2ccccc2CO 1458a_100011301526_100000705612 [0,0,1,0,0,0|1,0,2]=4 78 B18R2.3047 O=Ic1ccccc1C(=O)Cc2ccccc2 1458a_100000032414_100015291786 [0,0,1,0,0,0|1,0,0]=2 79 B18R2.3047 O=Ic1ccccc1C(=O)Cc2ccccn2 1458a_100000032414_100000721315 [0,0,1,0,0,0|2,0,0]=3 80 B18R2.3047 O=Ic1ccccc1C(=O)Cc2cccnc2 1458a_100000032414_100000733263 [0,0,1,0,0,0|2,0,0]=3 81 B18R2.3047 O=Ic1ccccc1C(=O)Cc2cccnn2 1458a_100000032414_100016990269 [0,0,1,0,0,0|3,0,0]=4 82 B18R2.3047 O=Ic1ccccc1C(=O)Cc2ccncc2 1458a_100000032414_100000705612 [0,0,1,0,0,0|2,0,0]=3 83 B18R2.3047 O=Ic1ccccc1C(=O)Cc2cnccn2 1458a_100000032414_100016995436 [0,0,1,0,0,0|3,0,0]=4 84 B18R2.3047 O=Ic1ccccc1C(=O)Cc2cncnc2 1458a_100000032414_100015196519 [0,0,1,0,0,0|3,0,0]=4 85 B18R2.3047 O=Ic1ccccc1C(=O)Cc2ncccn2 1458a_100000032414_100000703007 [0,0,1,0,0,0|3,0,0]=4 86 B18R2.3047 O=Ic1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000032414 [0,0,1,0,0,0|2,0,0]=3 87 B18R2.3047 O=Ic1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000032414 [0,0,1,0,0,0|2,0,0]=3 88 B18R2.3047 O=Ic1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000032414 [0,0,1,0,0,0|2,0,0]=3 89 B18R2.3047 [13CH3]Nc1ccccc1C(=O)Nc2ccccc2 34a_200005462405_200025704644 [0,0,1,0,0,0|3,0,0]=4 90 B18R2.3047 [13CH3]Oc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_200025704644 [0,0,1,0,0,0|2,0,0]=3 91 B18R2.3047 [13CH3]Oc1ccccc1C(=O)Nc2ccccc2 34a_100000263231_200025704644 [0,0,1,0,0,0|3,0,0]=4 92 B18R2.3047 [13CH3]Oc1ccccc1C(=O)Nc2ccccc2 7a_100000263231_200025704644 [0,0,1,0,0,0|3,0,0]=4 93 B18R2.3047 [13CH3]Oc1ccccc1C(=O)Oc2ccccc2 7a_100005462448_200025704644 [0,0,1,0,0,0|3,0,0]=4 94 B18R3.59119 O=C1c2ccccc2C(=O)C1N3CC=CC3 269982a_100015195280_200009813996 [0,0,0,0,1,0|1,0,2]=4 95 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccccc3 62a_100000719477_200009813996 [0,0,0,0,0,1|0,0,0]=1 96 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccccc3 62a_200009813996_100000041952 [0,0,0,0,0,1|0,0,0]=1 97 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccccn3 62a_100011216584_200009813996 [0,0,0,0,0,1|1,0,0]=2 98 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccccn3 62a_200009813996_100011216584 [0,0,0,0,0,1|1,0,0]=2 99 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cccnc3 62a_100000210063_200009813996 [0,0,0,0,0,1|1,0,0]=2 100 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cccnc3 62a_200009813996_100000210063 [0,0,0,0,0,1|1,0,0]=2 101 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cccnn3 62a_100016991348_200009813996 [0,0,0,0,0,1|2,0,0]=3 102 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cccnn3 62a_200009813996_100016991348 [0,0,0,0,0,1|2,0,0]=3 103 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccncc3 62a_100000728582_200009813996 [0,0,0,0,0,1|1,0,0]=2 104 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccncc3 62a_200009813996_100000728582 [0,0,0,0,0,1|1,0,0]=2 105 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccncn3 62a_100000703185_200009813996 [0,0,0,0,0,1|2,0,0]=3 106 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccncn3 62a_200009813996_100000703185 [0,0,0,0,0,1|2,0,0]=3 107 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccnnc3 62a_100000732662_200009813996 [0,0,0,0,0,1|2,0,0]=3 108 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ccnnc3 62a_200009813996_100000732662 [0,0,0,0,0,1|2,0,0]=3 109 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cnccn3 62a_100000211759_200009813996 [0,0,0,0,0,1|2,0,0]=3 110 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cnccn3 62a_200009813996_100000211759 [0,0,0,0,0,1|2,0,0]=3 111 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cncnc3 62a_100011206942_200009813996 [0,0,0,0,0,1|2,0,0]=3 112 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cncnc3 62a_200009813996_100011206942 [0,0,0,0,0,1|2,0,0]=3 113 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cnnnc3 62a_100009846058_200009813996 [0,0,0,0,0,1|3,0,0]=4 114 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3cnnnc3 62a_200009813996_100009846058 [0,0,0,0,0,1|3,0,0]=4 115 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ncccn3 62a_100000211032_200009813996 [0,0,0,0,0,1|2,0,0]=3 116 B20R3.8816 O=C1c2ccccc2C(=O)C1Sc3ncccn3 62a_200009813996_100000211032 [0,0,0,0,0,1|2,0,0]=3 117 B20R3.13141 Cc1c(c(nc2c1cccc2)O)c3ccccc3 271570a_100011218836_100009820873 [0,0,0,0,0,1|1,0,2]=4 118 B17R2.162 C=CC(Sc1ccccc1)c2ccccc2 62a_100000719477_200000085779 [1,0,1,0,0,0|2,0,0]=4 119 B17R2.162 C=CC(Sc1ccccc1)c2ccccc2 62a_200000085779_100000041952 [1,0,1,0,0,0|2,0,0]=4 120 B17R2.10205 CC(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000230085 [1,0,1,0,0,0|0,0,1]=3 121 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 11a_100000210012_100000185807 [1,0,1,0,0,0|1,0,1]=4 122 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 1626a_100000210012_100000185807 [1,0,1,0,0,0|1,0,1]=4 123 B17R2.10205 CN(C(=O)c1ccccc1)c2ccccc2 22a_100000210012_100000185807 [1,0,1,0,0,0|1,0,1]=4 124 B17R2.262 C=Cc1ccccc1NCc2ccccc2 207a_100012022501_100015611070 [1,0,1,0,0,0|2,0,0]=4 125 B17R2.262 C=Cc1ccccc1NCc2ccccc2 34a_100012022501_100015291786 [1,0,1,0,0,0|2,0,0]=4 126 B17R2.262 C=Cc1ccccc1OCc2ccccc2 271570a_100011290941_100000151716 [1,0,1,0,0,0|2,0,0]=4 127 B17R2.262 C=Cc1ccccc1SCc2ccccc2 62a_100000211182_100011218376 [1,0,1,0,0,0|2,0,0]=4 128 B17R2.262 C=Cc1ccccc1SCc2ccccc2 62a_100011218376_100015291786 [1,0,1,0,0,0|2,0,0]=4 129 B17R2.262 O=Cc1ccccc1C#Cc2ccccc2 271570a_100000069678_100000211189 [1,0,1,0,0,0|0,0,2]=4 130 B17R2.262 O=Cc1ccccc1C=Cc2ccccc2 271570a_100102527694_100000211189 [1,0,1,0,0,0|0,0,1]=3 131 B17R2.262 O=Cc1ccccc1C=Cc2cccnc2 271570a_100102525586_100000211189 [1,0,1,0,0,0|1,0,1]=4 132 B17R2.262 O=Cc1ccccc1CNc2ccccc2 34a_100000106764_200009853537 [1,0,1,0,0,0|1,0,1]=4 133 B17R2.262 O=Cc1ccccc1COc2ccccc2 34a_100000210340_200009853537 [1,0,1,0,0,0|1,0,1]=4 134 B17R2.262 O=Cc1ccccc1COc2ccccc2 7a_100000210340_200009853537 [1,0,1,0,0,0|1,0,1]=4 135 B17R2.262 O=Cc1ccccc1CSc2ccccc2 62a_100000719477_200009853537 [1,0,1,0,0,0|1,0,1]=4 136 B17R2.262 O=Cc1ccccc1CSc2ccccc2 62a_200009853537_100000041952 [1,0,1,0,0,0|1,0,1]=4 137 B17R2.262 O=Cc1ccccc1SCc2ccccc2 62a_100000210073_100015291786 [1,0,1,0,0,0|1,0,0]=3 138 B17R2.262 O=Cc1ccccc1SCc2ccccc2 62a_100000211182_100000210073 [1,0,1,0,0,0|1,0,0]=3 139 B17R2.262 O=Cc1ccccc1SCc2ccccn2 62a_100000210073_100000721315 [1,0,1,0,0,0|2,0,0]=4 140 B17R2.262 O=Cc1ccccc1SCc2ccccn2 62a_100000721315_100000210073 [1,0,1,0,0,0|2,0,0]=4 141 B17R2.262 O=Cc1ccccc1SCc2cccnc2 62a_100000210073_100000741622 [1,0,1,0,0,0|2,0,0]=4 142 B17R2.262 O=Cc1ccccc1SCc2cccnc2 62a_100000741622_100000210073 [1,0,1,0,0,0|2,0,0]=4 143 B17R2.262 O=Cc1ccccc1SCc2ccncc2 62a_100000210073_100015193705 [1,0,1,0,0,0|2,0,0]=4 144 B17R2.262 O=Cc1ccccc1SCc2ccncc2 62a_100015193705_100000210073 [1,0,1,0,0,0|2,0,0]=4 145 B17R2.262 O=Cc1cccnc1C=Cc2ccccc2 271570a_100102527694_100009816751 [1,0,1,0,0,0|1,0,1]=4 146 B17R2.262 O=Cc1cccnc1SCc2ccccc2 62a_100000211182_100009816751 [1,0,1,0,0,0|2,0,0]=4 147 B17R2.262 O=Cc1cccnc1SCc2ccccc2 62a_100009816751_100015291786 [1,0,1,0,0,0|2,0,0]=4 148 B17R2.262 O=Cc1ccncc1C=Cc2ccccc2 271570a_100102527694_100011934409 [1,0,1,0,0,0|1,0,1]=4 149 B17R2.262 O=Cc1ccncc1SCc2ccccc2 62a_100000211182_100011934409 [1,0,1,0,0,0|2,0,0]=4 150 B17R2.262 O=Cc1ccncc1SCc2ccccc2 62a_100011934409_100015291786 [1,0,1,0,0,0|2,0,0]=4 151 B17R2.262 O=Cc1cnccc1C=Cc2ccccc2 271570a_100102527694_100000050567 [1,0,1,0,0,0|1,0,1]=4 152 B17R2.262 O=Cc1cnccc1SCc2ccccc2 62a_100000050567_100015291786 [1,0,1,0,0,0|2,0,0]=4 153 B17R2.262 O=Cc1cnccc1SCc2ccccc2 62a_100000211182_100000050567 [1,0,1,0,0,0|2,0,0]=4 154 B17R2.262 O=Cc1ncccc1C=Cc2ccccc2 271570a_100102527694_100011934733 [1,0,1,0,0,0|1,0,1]=4 155 B17R2.262 O=Cc1ncccc1SCc2ccccc2 62a_100000211182_100011934733 [1,0,1,0,0,0|2,0,0]=4 156 B17R2.262 O=Cc1ncccc1SCc2ccccc2 62a_100011934733_100015291786 [1,0,1,0,0,0|2,0,0]=4 157 B17R2.3417 Cc1ccccc1C(=O)Cc2ccccc2 1458a_100000212026_100015291786 [1,0,1,0,0,0|0,0,1]=3 158 B17R2.3417 Cc1ccccc1C(=O)Cc2ccccn2 1458a_100000212026_100000721315 [1,0,1,0,0,0|1,0,1]=4 159 B17R2.3417 Cc1ccccc1C(=O)Cc2cccnc2 1458a_100000212026_100000733263 [1,0,1,0,0,0|1,0,1]=4 160 B17R2.3417 Cc1ccccc1C(=O)Cc2ccncc2 1458a_100000212026_100000705612 [1,0,1,0,0,0|1,0,1]=4 161 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 11a_100000106764_100000212026 [1,0,1,0,0,0|1,0,1]=4 162 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000212026 [1,0,1,0,0,0|1,0,1]=4 163 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000212026 [1,0,1,0,0,0|1,0,1]=4 164 B17R2.3417 Cc1ccccc1C(=O)Nc2ccccc2 527a_100000106764_100000212026 [1,0,1,0,0,0|1,0,1]=4 165 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Br 1458a_100000188424_100015291786 [1,0,1,0,0,0|1,0,0]=3 166 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2Cl 1458a_100000185844_100015291786 [1,0,1,0,0,0|1,0,0]=3 167 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2F 1458a_100000188656_100015291786 [1,0,1,0,0,0|1,0,0]=3 168 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2I 1458a_100000187884_100015291786 [1,0,1,0,0,0|1,0,0]=3 169 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2O 1458a_100015234032_100015291786 [1,0,1,0,0,0|0,0,1]=3 170 B17R2.3417 O=C(Cc1ccccc1)c2ccccc2[O-] 1458a_100009911694_100015291786 [1,0,1,0,0,0|0,0,1]=3 171 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2Br 1458a_100000188424_100000721315 [1,0,1,0,0,0|2,0,0]=4 172 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2Cl 1458a_100000185844_100000721315 [1,0,1,0,0,0|2,0,0]=4 173 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2F 1458a_100000188656_100000721315 [1,0,1,0,0,0|2,0,0]=4 174 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2I 1458a_100000187884_100000721315 [1,0,1,0,0,0|2,0,0]=4 175 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2O 1458a_100015234032_100000721315 [1,0,1,0,0,0|1,0,1]=4 176 B17R2.3417 O=C(Cc1ccccn1)c2ccccc2[O-] 1458a_100009911694_100000721315 [1,0,1,0,0,0|1,0,1]=4 177 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2Br 1458a_100000188424_100000733263 [1,0,1,0,0,0|2,0,0]=4 178 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2Cl 1458a_100000185844_100000733263 [1,0,1,0,0,0|2,0,0]=4 179 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2F 1458a_100000188656_100000733263 [1,0,1,0,0,0|2,0,0]=4 180 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2I 1458a_100000187884_100000733263 [1,0,1,0,0,0|2,0,0]=4 181 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2O 1458a_100015234032_100000733263 [1,0,1,0,0,0|1,0,1]=4 182 B17R2.3417 O=C(Cc1cccnc1)c2ccccc2[O-] 1458a_100009911694_100000733263 [1,0,1,0,0,0|1,0,1]=4 183 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2Br 1458a_100000188424_100000705612 [1,0,1,0,0,0|2,0,0]=4 184 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2Cl 1458a_100000185844_100000705612 [1,0,1,0,0,0|2,0,0]=4 185 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2F 1458a_100000188656_100000705612 [1,0,1,0,0,0|2,0,0]=4 186 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2I 1458a_100000187884_100000705612 [1,0,1,0,0,0|2,0,0]=4 187 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2O 1458a_100015234032_100000705612 [1,0,1,0,0,0|1,0,1]=4 188 B17R2.3417 O=C(Cc1ccncc1)c2ccccc2[O-] 1458a_100009911694_100000705612 [1,0,1,0,0,0|1,0,1]=4 189 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 11a_100000106764_100000188424 [1,0,1,0,0,0|2,0,0]=4 190 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 1626a_100000106764_100000188424 [1,0,1,0,0,0|2,0,0]=4 191 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 22a_100000106764_100000188424 [1,0,1,0,0,0|2,0,0]=4 192 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Br 527a_100000106764_100000188424 [1,0,1,0,0,0|2,0,0]=4 193 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 11a_100000106764_100000185844 [1,0,1,0,0,0|2,0,0]=4 194 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 1626a_100000106764_100000185844 [1,0,1,0,0,0|2,0,0]=4 195 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 22a_100000106764_100000185844 [1,0,1,0,0,0|2,0,0]=4 196 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2Cl 527a_100000106764_100000185844 [1,0,1,0,0,0|2,0,0]=4 197 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 11a_100000106764_100000188656 [1,0,1,0,0,0|2,0,0]=4 198 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 1626a_100000106764_100000188656 [1,0,1,0,0,0|2,0,0]=4 199 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 22a_100000106764_100000188656 [1,0,1,0,0,0|2,0,0]=4 200 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2F 527a_100000106764_100000188656 [1,0,1,0,0,0|2,0,0]=4 201 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 11a_100000106764_100000187884 [1,0,1,0,0,0|2,0,0]=4 202 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 1626a_100000106764_100000187884 [1,0,1,0,0,0|2,0,0]=4 203 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 22a_100000106764_100000187884 [1,0,1,0,0,0|2,0,0]=4 204 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2I 527a_100000106764_100000187884 [1,0,1,0,0,0|2,0,0]=4 205 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2O 22a_100000106764_100015234032 [1,0,1,0,0,0|1,0,1]=4 206 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 1626a_100000106764_100009911694 [1,0,1,0,0,0|1,0,1]=4 207 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 22a_100000106764_100009911694 [1,0,1,0,0,0|1,0,1]=4 208 B17R2.3417 O=C(Nc1ccccc1)c2ccccc2[O-] 527a_100000106764_100009911694 [1,0,1,0,0,0|1,0,1]=4 209 B17R2.2094 C=CC=CC(=O)C1Cc2ccccc2C1=O 1458a_100016291481_100011218503 [1,0,1,0,0,0|1,0,1]=4 210 B17R3.8708 C1=C(Cc2c1cccc2)c3ccccc3 271570a_100010239756_100000210277 [2,0,0,0,0,0|0,0,2]=4 211 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100010206980_100000210277 [2,0,0,0,0,0|1,0,1]=4 212 B17R3.8708 c1ccc(cc1)c2cc3ccccc3[nH]2 271570a_100011218836_100010232065 [2,0,0,0,0,0|1,0,1]=4 213 B17R3.8708 c1ccc(cc1)c2cc3ccccc3o2 271570a_100011218836_100010159458 [2,0,0,0,0,0|1,0,1]=4 214 B17R3.8708 c1ccc(cc1)c2cc3ccccc3o2 271570a_100011328764_100000210277 [2,0,0,0,0,0|1,0,1]=4 215 B17R3.8708 c1ccc(cc1)c2cc3ccccc3s2 271570a_100000034353_100000210277 [2,0,0,0,0,0|1,0,1]=4 216 B17R3.8708 c1ccc(cc1)c2cc3ccccc3s2 271570a_100011218836_100009816949 [2,0,0,0,0,0|1,0,1]=4 217 B19R2.2278 CNC(C(=O)c1ccc(cc1)Cl)c2ccccc2 2230a_106832991635_100014546569 [0,1,1,0,0,0|2,0,0]=4 218 B19R2.2278 CNC(C(=O)c1ccc(cc1)F)c2ccccc2 2230a_106832991635_100020642289 [0,1,1,0,0,0|2,0,0]=4 219 B19R2.2278 COC(C(=O)c1ccc(cc1)Cl)c2ccccc2 34a_200005794345_200000210301 [0,1,1,0,0,0|2,0,0]=4 220 B19R2.2278 COC(C(=O)c1ccc(cc1)Cl)c2ccccc2 7a_200005794345_200000210301 [0,1,1,0,0,0|2,0,0]=4 221 B19R2.2278 CSC(C(=O)c1ccc(cc1)Cl)c2ccccc2 62a_100014546569_200000210301 [0,1,1,0,0,0|2,0,0]=4 222 B19R2.2278 CSC(C(=O)c1ccc(cc1)Cl)c2ccccc2 62a_200000210301_100014546569 [0,1,1,0,0,0|2,0,0]=4 223 B19R2.2278 CSC(C(=O)c1ccc(cc1)F)c2ccccc2 62a_100020642289_200000210301 [0,1,1,0,0,0|2,0,0]=4 224 B19R2.2278 CSC(C(=O)c1ccc(cc1)F)c2ccccc2 62a_200000210301_100020642289 [0,1,1,0,0,0|2,0,0]=4 225 B19R2.2278 [13CH3]OC(C(=O)c1ccc(cc1)Cl)c2ccccc2 34a_200005794345_200025704644 [0,1,1,0,0,0|2,0,0]=4 226 B19R2.2278 [13CH3]OC(C(=O)c1ccc(cc1)Cl)c2ccccc2 7a_200005794345_200025704644 [0,1,1,0,0,0|2,0,0]=4 227 B19R2.2278 [13CH3]SC(C(=O)c1ccc(cc1)Cl)c2ccccc2 62a_100014546569_200025704644 [0,1,1,0,0,0|2,0,0]=4 228 B19R2.2278 [13CH3]SC(C(=O)c1ccc(cc1)Cl)c2ccccc2 62a_200025704644_100014546569 [0,1,1,0,0,0|2,0,0]=4 229 B19R2.2278 [13CH3]SC(C(=O)c1ccc(cc1)F)c2ccccc2 62a_100020642289_200025704644 [0,1,1,0,0,0|2,0,0]=4 230 B19R2.2278 [13CH3]SC(C(=O)c1ccc(cc1)F)c2ccccc2 62a_200025704644_100020642289 [0,1,1,0,0,0|2,0,0]=4 231 B19R2.9816 C=CCN(C(=O)c1ccccc1)c2ccccc2 11a_100000211662_100000185807 [0,1,1,0,0,0|2,0,0]=4 232 B19R2.9816 C=CCN(C(=O)c1ccccc1)c2ccccc2 1626a_100000211662_100000185807 [0,1,1,0,0,0|2,0,0]=4 233 B19R2.9816 C=CCN(C(=O)c1ccccc1)c2ccccc2 22a_100000211662_100000185807 [0,1,1,0,0,0|2,0,0]=4 234 B19R2.9816 CCNC(C(=O)c1ccccc1)c2ccccc2 2230a_100015525214_100000211254 [0,1,1,0,0,0|1,0,1]=4 235 B19R2.9816 CCOC(C(=O)c1ccccc1)c2ccccc2 7a_100000185998_100000210202 [0,1,1,0,0,0|1,0,1]=4 236 B19R2.9816 CCSC(C(=O)c1ccccc1)c2ccccc2 62a_100000210202_100000211254 [0,1,1,0,0,0|1,0,1]=4 237 B19R2.9816 CCSC(C(=O)c1ccccc1)c2ccccc2 62a_100000211254_100000210202 [0,1,1,0,0,0|1,0,1]=4 238 B19R2.9816 O=C(c1ccccc1)C(CCCl)c2ccccc2 1458a_100000185807_200010132975 [0,1,1,0,0,0|1,0,1]=4 239 B19R2.9816 O=C(c1ccccc1)C(OCF)c2ccccc2 7a_100000185998_100015361967 [0,1,1,0,0,0|1,0,1]=4 240 B19R2.9816 O=C(c1ccccc1)C(SCF)c2ccccc2 62a_100000211254_100015361967 [0,1,1,0,0,0|1,0,1]=4 241 B19R2.9816 O=C(c1ccccc1)C(SCF)c2ccccc2 62a_100015361967_100000211254 [0,1,1,0,0,0|1,0,1]=4 242 B19R2.28123 CC(O[13CH3])(C(=O)c1ccccc1)c2ccccc2 7a_100016999863_200025704644 [0,1,1,0,0,0|2,0,0]=4 243 B19R2.28123 COC(C)(C(=O)c1ccccc1)c2ccccc2 7a_100016999863_200000210301 [0,1,1,0,0,0|2,0,0]=4 244 B19R2.113617 CC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000070787_100000211254 [0,1,1,0,0,0|0,0,0]=2 245 B19R2.113617 CC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100009888967 [0,1,1,0,0,0|0,0,0]=2 246 B19R2.113617 CC(=O)C(c1ccccc1)N(C)c2ccccc2 2230a_100000210012_100009888967 [0,1,1,0,0,0|2,0,0]=4 247 B19R2.113617 CC(=O)C(c1ccccc1)N(C)c2ccccc2 269982a_100000210012_100009888967 [0,1,1,0,0,0|2,0,0]=4 248 B19R2.113617 CN(C)C(C(=O)c1ccccc1)c2ccccc2 2230a_100102631434_100000211254 [0,1,1,0,0,0|2,0,0]=4 249 B19R2.113617 CN(C)C(C(=O)c1ccccc1)c2ccccc2 269982a_100102631434_100000211254 [0,1,1,0,0,0|2,0,0]=4 250 B19R2.113617 CN(c1ccccc1)C(C(=O)N)c2ccccc2 2230a_100000210012_100000188848 [0,1,1,0,0,0|2,0,0]=4 251 B19R2.113617 CN(c1ccccc1)C(C(=O)N)c2ccccc2 269982a_100000210012_100000188848 [0,1,1,0,0,0|2,0,0]=4 252 B19R2.113617 CN(c1ccccc1)C(C(=O)O)c2ccccc2 269956a_100005477724_200000210301 [0,1,1,0,0,0|2,0,0]=4 253 B19R2.113617 NC(=O)C(C(=O)c1ccccc1)c2ccccc2 1458a_100000185807_100000188848 [0,1,1,0,0,0|0,0,0]=2 254 B19R2.113617 [13CH3]N(c1ccccc1)C(C(=O)O)c2ccccc2 269956a_100005477724_200025704644 [0,1,1,0,0,0|2,0,0]=4 255 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)Br 1458a_100011593405_100015291786 [0,1,1,0,0,0|2,0,0]=4 256 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)C 1458a_100000066212_100015291786 [0,1,1,0,0,0|2,0,0]=4 257 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)Cl 1458a_100000743539_100015291786 [0,1,1,0,0,0|2,0,0]=4 258 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)F 1458a_100000759380_100015291786 [0,1,1,0,0,0|2,0,0]=4 259 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)I 1458a_100010179659_100015291786 [0,1,1,0,0,0|2,0,0]=4 260 B19R2.912 COc1cccc(c1C(=O)Cc2ccccc2)O 1458a_100000043310_100015291786 [0,1,1,0,0,0|2,0,0]=4 261 B19R2.912 N#Cc1cccc(c1C(=O)Cc2ccccc2)Br 1458a_200010145881_100015291786 [0,1,1,0,0,0|1,0,1]=4 262 B19R2.2713 CCc1ccc(cc1C(=O)Cc2ccccc2)Br 1458a_100012343961_100015291786 [0,1,1,0,0,0|1,0,1]=4 263 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)Br 1458a_100000188853_100015291786 [0,1,1,0,0,0|2,0,0]=4 264 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)C 1458a_100000204667_100015291786 [0,1,1,0,0,0|2,0,0]=4 265 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)Cl 1458a_100000211409_100015291786 [0,1,1,0,0,0|2,0,0]=4 266 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)F 1458a_100000735445_100015291786 [0,1,1,0,0,0|2,0,0]=4 267 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)I 1458a_100000230898_100015291786 [0,1,1,0,0,0|2,0,0]=4 268 B19R2.2713 COc1ccc(cc1C(=O)Cc2ccccc2)O 1458a_200000100057_100015291786 [0,1,1,0,0,0|2,0,0]=4 269 B19R2.2713 N#Cc1ccc(cc1C(=O)Cc2ccccc2)F 1458a_100011217471_100015291786 [0,1,1,0,0,0|1,0,1]=4 270 B19R2.2816 CCc1cc(ccc1C(=O)Cc2ccccc2)Br 1458a_200012349896_100015291786 [0,1,1,0,0,0|1,0,1]=4 271 B19R2.2816 COc1cc(ccc1C(=O)Cc2ccccc2)Br 1458a_100000748230_100015291786 [0,1,1,0,0,0|2,0,0]=4 272 B19R2.2816 COc1cc(ccc1C(=O)Cc2ccccc2)C 1458a_100000217210_100015291786 [0,1,1,0,0,0|2,0,0]=4 273 B19R2.2816 COc1cc(ccc1C(=O)Cc2ccccc2)Cl 1458a_100000217211_100015291786 [0,1,1,0,0,0|2,0,0]=4 274 B19R2.2816 COc1cc(ccc1C(=O)Cc2ccccc2)F 1458a_100000239970_100015291786 [0,1,1,0,0,0|2,0,0]=4 275 B19R2.2816 COc1cc(ccc1C(=O)Cc2ccccc2)I 1458a_100012353712_100015291786 [0,1,1,0,0,0|2,0,0]=4 276 B19R2.2816 Cc1ccc(c(c1)C#N)C(=O)Cc2ccccc2 1458a_200012184421_100015291786 [0,1,1,0,0,0|1,0,1]=4 277 B19R2.2816 N#Cc1cc(ccc1C(=O)Cc2ccccc2)Br 1458a_100012349539_100015291786 [0,1,1,0,0,0|1,0,1]=4 278 B19R2.2816 N#Cc1cc(ccc1C(=O)Cc2ccccc2)F 1458a_100012002388_100015291786 [0,1,1,0,0,0|1,0,1]=4 279 B19R2.2816 O=C(Cc1ccccc1)c2ccc(cc2CO)Br 1458a_100010253900_100015291786 [0,1,1,0,0,0|0,0,2]=4 280 B19R2.2816 O=C(Cc1ccccc1)c2ccc(cc2CO)F 1458a_100013035055_100015291786 [0,1,1,0,0,0|0,0,2]=4 281 B19R2.3353 C#Cc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100011243808_100000189115 [0,1,1,0,0,0|1,0,1]=4 282 B19R2.3353 C#Cc1ccccc1C(=O)Cc2ccc(cc2)C 1458a_100011243808_100000210814 [0,1,1,0,0,0|1,0,1]=4 283 B19R2.3353 C#Cc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100011243808_100000694040 [0,1,1,0,0,0|1,0,1]=4 284 B19R2.3353 C#Cc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100011243808_100000198546 [0,1,1,0,0,0|1,0,1]=4 285 B19R2.3353 C#Cc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100011243808_100000189116 [0,1,1,0,0,0|1,0,1]=4 286 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100011830265_100000189115 [0,1,1,0,0,0|1,0,0]=3 287 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cc2)C 1458a_100011830265_100000210814 [0,1,1,0,0,0|1,0,0]=3 288 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100011830265_100000694040 [0,1,1,0,0,0|1,0,0]=3 289 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100011830265_100000198546 [0,1,1,0,0,0|1,0,0]=3 290 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100011830265_100000189116 [0,1,1,0,0,0|1,0,0]=3 291 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cn2)Br 1458a_100011830265_100000702658 [0,1,1,0,0,0|2,0,0]=4 292 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cn2)C 1458a_100011830265_100000691093 [0,1,1,0,0,0|2,0,0]=4 293 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cn2)Cl 1458a_100011830265_100012066911 [0,1,1,0,0,0|2,0,0]=4 294 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(cn2)F 1458a_100011830265_100000703193 [0,1,1,0,0,0|2,0,0]=4 295 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(nc2)Br 1458a_100011830265_100009831999 [0,1,1,0,0,0|2,0,0]=4 296 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(nc2)C 1458a_100011830265_100016987292 [0,1,1,0,0,0|2,0,0]=4 297 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(nc2)Cl 1458a_100011830265_100000735431 [0,1,1,0,0,0|2,0,0]=4 298 B19R2.3353 C=Cc1ccccc1C(=O)Cc2ccc(nc2)F 1458a_100011830265_100009820150 [0,1,1,0,0,0|2,0,0]=4 299 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)Br 1626a_100000210018_100011830265 [0,1,1,0,0,0|2,0,0]=4 300 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)Br 22a_100000210018_100011830265 [0,1,1,0,0,0|2,0,0]=4 301 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)C 1626a_100000124888_100011830265 [0,1,1,0,0,0|2,0,0]=4 302 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)C 22a_100000124888_100011830265 [0,1,1,0,0,0|2,0,0]=4 303 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100011830265 [0,1,1,0,0,0|2,0,0]=4 304 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100011830265 [0,1,1,0,0,0|2,0,0]=4 305 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)F 1626a_100000185862_100011830265 [0,1,1,0,0,0|2,0,0]=4 306 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)F 22a_100000185862_100011830265 [0,1,1,0,0,0|2,0,0]=4 307 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)I 1626a_100000185761_100011830265 [0,1,1,0,0,0|2,0,0]=4 308 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)I 22a_100000185761_100011830265 [0,1,1,0,0,0|2,0,0]=4 309 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)N 271570a_100011290941_100000630993 [0,1,1,0,0,0|2,0,0]=4 310 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)O 22a_100000185829_100011830265 [0,1,1,0,0,0|2,0,0]=4 311 B19R2.3353 C=Cc1ccccc1C(=O)Nc2ccc(cc2)O 271570a_100011290941_100000261451 [0,1,1,0,0,0|2,0,0]=4 312 B19R2.3353 CCc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100000689120_100000189115 [0,1,1,0,0,0|1,0,1]=4 313 B19R2.3353 CCc1ccccc1C(=O)Cc2ccc(cc2)C 1458a_100000689120_100000210814 [0,1,1,0,0,0|1,0,1]=4 314 B19R2.3353 CCc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100000689120_100000694040 [0,1,1,0,0,0|1,0,1]=4 315 B19R2.3353 CCc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100000689120_100000198546 [0,1,1,0,0,0|1,0,1]=4 316 B19R2.3353 CCc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100000689120_100000189116 [0,1,1,0,0,0|1,0,1]=4 317 B19R2.3353 COc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100000185835_100000189115 [0,1,1,0,0,0|2,0,0]=4 318 B19R2.3353 COc1ccccc1C(=O)Cc2ccc(cc2)C 1458a_100000185835_100000210814 [0,1,1,0,0,0|2,0,0]=4 319 B19R2.3353 COc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100000185835_100000694040 [0,1,1,0,0,0|2,0,0]=4 320 B19R2.3353 COc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100000185835_100000198546 [0,1,1,0,0,0|2,0,0]=4 321 B19R2.3353 COc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100000185835_100000189116 [0,1,1,0,0,0|2,0,0]=4 322 B19R2.3353 CSc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100000183967_100000189115 [0,1,1,0,0,0|2,0,0]=4 323 B19R2.3353 CSc1ccccc1C(=O)Cc2ccc(cc2)C 1458a_100000183967_100000210814 [0,1,1,0,0,0|2,0,0]=4 324 B19R2.3353 CSc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100000183967_100000694040 [0,1,1,0,0,0|2,0,0]=4 325 B19R2.3353 CSc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100000183967_100000198546 [0,1,1,0,0,0|2,0,0]=4 326 B19R2.3353 CSc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100000183967_100000189116 [0,1,1,0,0,0|2,0,0]=4 327 B19R2.3353 Cc1ccc(cc1)CC(=O)c2ccccc2C#N 1458a_100000742908_100000210814 [0,1,1,0,0,0|1,0,1]=4 328 B19R2.3353 Cc1ccc(cc1)CC(=O)c2ccccc2CO 1458a_100011301526_100000210814 [0,1,1,0,0,0|0,0,2]=4 329 B19R2.3353 Cc1ccc(cc1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000210814 [0,1,1,0,0,0|1,0,0]=3 330 B19R2.3353 Cc1ccc(cc1)NC(=O)c2ccccc2I=O 1626a_100000124888_100000032414 [0,1,1,0,0,0|2,0,0]=4 331 B19R2.3353 Cc1ccc(cc1)NC(=O)c2ccccc2I=O 22a_100000124888_100000032414 [0,1,1,0,0,0|2,0,0]=4 332 B19R2.3353 Cc1ccc(cc1)NC(=O)c2ccccc2I=O 527a_100000124888_100000032414 [0,1,1,0,0,0|2,0,0]=4 333 B19R2.3353 Cc1ccc(cn1)CC(=O)c2ccccc2I=O 1458a_100000032414_100016987292 [0,1,1,0,0,0|2,0,0]=4 334 B19R2.3353 Cc1ccc(nc1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000691093 [0,1,1,0,0,0|2,0,0]=4 335 B19R2.3353 N#Cc1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100000742908_100000189115 [0,1,1,0,0,0|1,0,1]=4 336 B19R2.3353 N#Cc1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100000742908_100000694040 [0,1,1,0,0,0|1,0,1]=4 337 B19R2.3353 N#Cc1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100000742908_100000198546 [0,1,1,0,0,0|1,0,1]=4 338 B19R2.3353 N#Cc1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100000742908_100000189116 [0,1,1,0,0,0|1,0,1]=4 339 B19R2.3353 O=C(Cc1ccc(cc1)Br)c2ccccc2CO 1458a_100011301526_100000189115 [0,1,1,0,0,0|0,0,2]=4 340 B19R2.3353 O=C(Cc1ccc(cc1)Cl)c2ccccc2CO 1458a_100011301526_100000694040 [0,1,1,0,0,0|0,0,2]=4 341 B19R2.3353 O=C(Cc1ccc(cc1)F)c2ccccc2CO 1458a_100011301526_100000198546 [0,1,1,0,0,0|0,0,2]=4 342 B19R2.3353 O=C(Cc1ccc(cc1)I)c2ccccc2CO 1458a_100011301526_100000189116 [0,1,1,0,0,0|0,0,2]=4 343 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cc2)Br 1458a_100000032414_100000189115 [0,1,1,0,0,0|1,0,0]=3 344 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cc2)Cl 1458a_100000032414_100000694040 [0,1,1,0,0,0|1,0,0]=3 345 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cc2)F 1458a_100000032414_100000198546 [0,1,1,0,0,0|1,0,0]=3 346 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cc2)I 1458a_100000032414_100000189116 [0,1,1,0,0,0|1,0,0]=3 347 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cn2)Br 1458a_100000032414_100000702658 [0,1,1,0,0,0|2,0,0]=4 348 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cn2)Cl 1458a_100000032414_100012066911 [0,1,1,0,0,0|2,0,0]=4 349 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(cn2)F 1458a_100000032414_100000703193 [0,1,1,0,0,0|2,0,0]=4 350 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(nc2)Br 1458a_100000032414_100009831999 [0,1,1,0,0,0|2,0,0]=4 351 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(nc2)Cl 1458a_100000032414_100000735431 [0,1,1,0,0,0|2,0,0]=4 352 B19R2.3353 O=Ic1ccccc1C(=O)Cc2ccc(nc2)F 1458a_100000032414_100009820150 [0,1,1,0,0,0|2,0,0]=4 353 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Br 1626a_100000210018_100000032414 [0,1,1,0,0,0|2,0,0]=4 354 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Br 22a_100000210018_100000032414 [0,1,1,0,0,0|2,0,0]=4 355 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Br 527a_100000210018_100000032414 [0,1,1,0,0,0|2,0,0]=4 356 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Cl 1626a_100000210052_100000032414 [0,1,1,0,0,0|2,0,0]=4 357 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Cl 22a_100000210052_100000032414 [0,1,1,0,0,0|2,0,0]=4 358 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)Cl 527a_100000210052_100000032414 [0,1,1,0,0,0|2,0,0]=4 359 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)F 1626a_100000185862_100000032414 [0,1,1,0,0,0|2,0,0]=4 360 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)F 22a_100000185862_100000032414 [0,1,1,0,0,0|2,0,0]=4 361 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)F 527a_100000185862_100000032414 [0,1,1,0,0,0|2,0,0]=4 362 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)I 1626a_100000185761_100000032414 [0,1,1,0,0,0|2,0,0]=4 363 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)I 22a_100000185761_100000032414 [0,1,1,0,0,0|2,0,0]=4 364 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)I 527a_100000185761_100000032414 [0,1,1,0,0,0|2,0,0]=4 365 B19R2.3353 O=Ic1ccccc1C(=O)Nc2ccc(cc2)O 22a_100000185829_100000032414 [0,1,1,0,0,0|2,0,0]=4 366 B19R2.3393 C#Cc1ccccc1C(=O)C(C)c2ccccc2 1458a_100011243808_100000230085 [0,1,1,0,0,0|1,0,1]=4 367 B19R2.3393 C=Cc1ccccc1C(=O)C(C)c2ccccc2 1458a_100011830265_100000230085 [0,1,1,0,0,0|1,0,0]=3 368 B19R2.3393 C=Cc1ccccc1C(=O)N(C)c2ccccc2 1626a_100000210012_100011830265 [0,1,1,0,0,0|2,0,0]=4 369 B19R2.3393 C=Cc1ccccc1C(=O)N(C)c2ccccc2 22a_100000210012_100011830265 [0,1,1,0,0,0|2,0,0]=4 370 B19R2.3393 CC(C(=O)c1ccccc1C#N)c2ccccc2 1458a_100000742908_100000230085 [0,1,1,0,0,0|1,0,1]=4 371 B19R2.3393 CC(C(=O)c1ccccc1CO)c2ccccc2 1458a_100011301526_100000230085 [0,1,1,0,0,0|0,0,2]=4 372 B19R2.3393 CC(C(=O)c1ccccc1I=O)c2ccccc2 1458a_100000032414_100000230085 [0,1,1,0,0,0|1,0,0]=3 373 B19R2.3393 CCc1ccccc1C(=O)C(C)c2ccccc2 1458a_100000689120_100000230085 [0,1,1,0,0,0|1,0,1]=4 374 B19R2.3393 CN(C(=O)c1ccccc1I=O)c2ccccc2 1626a_100000210012_100000032414 [0,1,1,0,0,0|2,0,0]=4 375 B19R2.3393 CN(C(=O)c1ccccc1I=O)c2ccccc2 22a_100000210012_100000032414 [0,1,1,0,0,0|2,0,0]=4 376 B19R2.3393 COc1ccccc1C(=O)C(C)c2ccccc2 1458a_100000185835_100000230085 [0,1,1,0,0,0|2,0,0]=4 377 B19R2.3393 CSc1ccccc1C(=O)C(C)c2ccccc2 1458a_100000183967_100000230085 [0,1,1,0,0,0|2,0,0]=4 378 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100011243808_100000211773 [0,1,1,0,0,0|1,0,1]=4 379 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)C 1458a_100011243808_100000211840 [0,1,1,0,0,0|1,0,1]=4 380 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100011243808_100000181238 [0,1,1,0,0,0|1,0,1]=4 381 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100011243808_100000230114 [0,1,1,0,0,0|1,0,1]=4 382 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100011243808_100011218688 [0,1,1,0,0,0|1,0,1]=4 383 B19R2.3420 C#Cc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100011243808_100011660834 [0,1,1,0,0,0|1,0,1]=4 384 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cc(ccn2)Br 1458a_100011830265_100010173614 [0,1,1,0,0,0|2,0,0]=4 385 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cc(ccn2)C 1458a_100011830265_100000718516 [0,1,1,0,0,0|2,0,0]=4 386 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cc(ccn2)Cl 1458a_100011830265_100016988179 [0,1,1,0,0,0|2,0,0]=4 387 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100011830265_100000211773 [0,1,1,0,0,0|1,0,0]=3 388 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)C 1458a_100011830265_100000211840 [0,1,1,0,0,0|1,0,0]=3 389 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100011830265_100000181238 [0,1,1,0,0,0|1,0,0]=3 390 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100011830265_100000230114 [0,1,1,0,0,0|1,0,0]=3 391 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100011830265_100011218688 [0,1,1,0,0,0|1,0,0]=3 392 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100011830265_100011660834 [0,1,1,0,0,0|1,0,0]=3 393 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(n2)Br 1458a_100011830265_100009889011 [0,1,1,0,0,0|2,0,0]=4 394 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(n2)C 1458a_100011830265_100000757606 [0,1,1,0,0,0|2,0,0]=4 395 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(n2)Cl 1458a_100011830265_100000086093 [0,1,1,0,0,0|2,0,0]=4 396 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cccc(n2)F 1458a_100011830265_100009819644 [0,1,1,0,0,0|2,0,0]=4 397 B19R2.3420 C=Cc1ccccc1C(=O)Cc2ccnc(c2)Br 1458a_100011830265_100010243470 [0,1,1,0,0,0|2,0,0]=4 398 B19R2.3420 C=Cc1ccccc1C(=O)Cc2ccnc(c2)C 1458a_100011830265_200020672517 [0,1,1,0,0,0|2,0,0]=4 399 B19R2.3420 C=Cc1ccccc1C(=O)Cc2ccnc(c2)Cl 1458a_100011830265_100000764220 [0,1,1,0,0,0|2,0,0]=4 400 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cncc(c2)Br 1458a_100011830265_100011740620 [0,1,1,0,0,0|2,0,0]=4 401 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cncc(c2)C 1458a_100011830265_100000716715 [0,1,1,0,0,0|2,0,0]=4 402 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cncc(c2)Cl 1458a_100011830265_100016992070 [0,1,1,0,0,0|2,0,0]=4 403 B19R2.3420 C=Cc1ccccc1C(=O)Cc2cncc(c2)F 1458a_100011830265_100000725299 [0,1,1,0,0,0|2,0,0]=4 404 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)Br 1626a_100000210019_100011830265 [0,1,1,0,0,0|2,0,0]=4 405 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)Br 22a_100000210019_100011830265 [0,1,1,0,0,0|2,0,0]=4 406 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)C 1626a_100000188690_100011830265 [0,1,1,0,0,0|2,0,0]=4 407 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)C 22a_100000188690_100011830265 [0,1,1,0,0,0|2,0,0]=4 408 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)Cl 1626a_100000185859_100011830265 [0,1,1,0,0,0|2,0,0]=4 409 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)Cl 22a_100000185859_100011830265 [0,1,1,0,0,0|2,0,0]=4 410 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)F 1626a_100000210047_100011830265 [0,1,1,0,0,0|2,0,0]=4 411 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)F 22a_100000210047_100011830265 [0,1,1,0,0,0|2,0,0]=4 412 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)I 1626a_100000211102_100011830265 [0,1,1,0,0,0|2,0,0]=4 413 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)I 22a_100000211102_100011830265 [0,1,1,0,0,0|2,0,0]=4 414 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)O 1626a_100000210217_100011830265 [0,1,1,0,0,0|2,0,0]=4 415 B19R2.3420 C=Cc1ccccc1C(=O)Nc2cccc(c2)O 22a_100000210217_100011830265 [0,1,1,0,0,0|2,0,0]=4 416 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100000689120_100000211773 [0,1,1,0,0,0|1,0,1]=4 417 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)C 1458a_100000689120_100000211840 [0,1,1,0,0,0|1,0,1]=4 418 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100000689120_100000181238 [0,1,1,0,0,0|1,0,1]=4 419 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100000689120_100000230114 [0,1,1,0,0,0|1,0,1]=4 420 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100000689120_100011218688 [0,1,1,0,0,0|1,0,1]=4 421 B19R2.3420 CCc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100000689120_100011660834 [0,1,1,0,0,0|1,0,1]=4 422 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100000185835_100000211773 [0,1,1,0,0,0|2,0,0]=4 423 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)C 1458a_100000185835_100000211840 [0,1,1,0,0,0|2,0,0]=4 424 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100000185835_100000181238 [0,1,1,0,0,0|2,0,0]=4 425 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100000185835_100000230114 [0,1,1,0,0,0|2,0,0]=4 426 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100000185835_100011218688 [0,1,1,0,0,0|2,0,0]=4 427 B19R2.3420 COc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100000185835_100011660834 [0,1,1,0,0,0|2,0,0]=4 428 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100000183967_100000211773 [0,1,1,0,0,0|2,0,0]=4 429 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)C 1458a_100000183967_100000211840 [0,1,1,0,0,0|2,0,0]=4 430 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100000183967_100000181238 [0,1,1,0,0,0|2,0,0]=4 431 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100000183967_100000230114 [0,1,1,0,0,0|2,0,0]=4 432 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100000183967_100011218688 [0,1,1,0,0,0|2,0,0]=4 433 B19R2.3420 CSc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100000183967_100011660834 [0,1,1,0,0,0|2,0,0]=4 434 B19R2.3420 Cc1cc(ccn1)CC(=O)c2ccccc2I=O 1458a_100000032414_200020672517 [0,1,1,0,0,0|2,0,0]=4 435 B19R2.3420 Cc1cccc(c1)CC(=O)c2ccccc2C#N 1458a_100000742908_100000211840 [0,1,1,0,0,0|1,0,1]=4 436 B19R2.3420 Cc1cccc(c1)CC(=O)c2ccccc2CO 1458a_100011301526_100000211840 [0,1,1,0,0,0|0,0,2]=4 437 B19R2.3420 Cc1cccc(c1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000211840 [0,1,1,0,0,0|1,0,0]=3 438 B19R2.3420 Cc1cccc(c1)NC(=O)c2ccccc2I=O 1626a_100000188690_100000032414 [0,1,1,0,0,0|2,0,0]=4 439 B19R2.3420 Cc1cccc(c1)NC(=O)c2ccccc2I=O 22a_100000188690_100000032414 [0,1,1,0,0,0|2,0,0]=4 440 B19R2.3420 Cc1cccc(c1)NC(=O)c2ccccc2I=O 527a_100000188690_100000032414 [0,1,1,0,0,0|2,0,0]=4 441 B19R2.3420 Cc1cccc(n1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000757606 [0,1,1,0,0,0|2,0,0]=4 442 B19R2.3420 Cc1ccnc(c1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000718516 [0,1,1,0,0,0|2,0,0]=4 443 B19R2.3420 Cc1cncc(c1)CC(=O)c2ccccc2I=O 1458a_100000032414_100000716715 [0,1,1,0,0,0|2,0,0]=4 444 B19R2.3420 N#Cc1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100000742908_100000211773 [0,1,1,0,0,0|1,0,1]=4 445 B19R2.3420 N#Cc1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100000742908_100000181238 [0,1,1,0,0,0|1,0,1]=4 446 B19R2.3420 N#Cc1ccccc1C(=O)Cc2cccc(c2)F 1458a_100000742908_100000230114 [0,1,1,0,0,0|1,0,1]=4 447 B19R2.3420 N#Cc1ccccc1C(=O)Cc2cccc(c2)I 1458a_100000742908_100011218688 [0,1,1,0,0,0|1,0,1]=4 448 B19R2.3420 N#Cc1ccccc1C(=O)Cc2cccc(c2)O 1458a_100000742908_100011660834 [0,1,1,0,0,0|1,0,1]=4 449 B19R2.3420 O=C(Cc1cccc(c1)Br)c2ccccc2CO 1458a_100011301526_100000211773 [0,1,1,0,0,0|0,0,2]=4 450 B19R2.3420 O=C(Cc1cccc(c1)Cl)c2ccccc2CO 1458a_100011301526_100000181238 [0,1,1,0,0,0|0,0,2]=4 451 B19R2.3420 O=C(Cc1cccc(c1)F)c2ccccc2CO 1458a_100011301526_100000230114 [0,1,1,0,0,0|0,0,2]=4 452 B19R2.3420 O=C(Cc1cccc(c1)I)c2ccccc2CO 1458a_100011301526_100011218688 [0,1,1,0,0,0|0,0,2]=4 453 B19R2.3420 O=C(Cc1cccc(c1)O)c2ccccc2CO 1458a_100011301526_100011660834 [0,1,1,0,0,0|0,0,2]=4 454 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cc(ccn2)Br 1458a_100000032414_100010173614 [0,1,1,0,0,0|2,0,0]=4 455 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cc(ccn2)Cl 1458a_100000032414_100016988179 [0,1,1,0,0,0|2,0,0]=4 456 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(c2)Br 1458a_100000032414_100000211773 [0,1,1,0,0,0|1,0,0]=3 457 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(c2)Cl 1458a_100000032414_100000181238 [0,1,1,0,0,0|1,0,0]=3 458 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(c2)F 1458a_100000032414_100000230114 [0,1,1,0,0,0|1,0,0]=3 459 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(c2)I 1458a_100000032414_100011218688 [0,1,1,0,0,0|1,0,0]=3 460 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(c2)O 1458a_100000032414_100011660834 [0,1,1,0,0,0|1,0,0]=3 461 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(n2)Br 1458a_100000032414_100009889011 [0,1,1,0,0,0|2,0,0]=4 462 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(n2)Cl 1458a_100000032414_100000086093 [0,1,1,0,0,0|2,0,0]=4 463 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cccc(n2)F 1458a_100000032414_100009819644 [0,1,1,0,0,0|2,0,0]=4 464 B19R2.3420 O=Ic1ccccc1C(=O)Cc2ccnc(c2)Br 1458a_100000032414_100010243470 [0,1,1,0,0,0|2,0,0]=4 465 B19R2.3420 O=Ic1ccccc1C(=O)Cc2ccnc(c2)Cl 1458a_100000032414_100000764220 [0,1,1,0,0,0|2,0,0]=4 466 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cncc(c2)Br 1458a_100000032414_100011740620 [0,1,1,0,0,0|2,0,0]=4 467 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cncc(c2)Cl 1458a_100000032414_100016992070 [0,1,1,0,0,0|2,0,0]=4 468 B19R2.3420 O=Ic1ccccc1C(=O)Cc2cncc(c2)F 1458a_100000032414_100000725299 [0,1,1,0,0,0|2,0,0]=4 469 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)Br 1626a_100000210019_100000032414 [0,1,1,0,0,0|2,0,0]=4 470 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)Br 22a_100000210019_100000032414 [0,1,1,0,0,0|2,0,0]=4 471 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)Br 527a_100000210019_100000032414 [0,1,1,0,0,0|2,0,0]=4 472 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)Cl 1626a_100000185859_100000032414 [0,1,1,0,0,0|2,0,0]=4 473 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)Cl 22a_100000185859_100000032414 [0,1,1,0,0,0|2,0,0]=4 474 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)F 1626a_100000210047_100000032414 [0,1,1,0,0,0|2,0,0]=4 475 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)F 22a_100000210047_100000032414 [0,1,1,0,0,0|2,0,0]=4 476 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)F 527a_100000210047_100000032414 [0,1,1,0,0,0|2,0,0]=4 477 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)I 1626a_100000211102_100000032414 [0,1,1,0,0,0|2,0,0]=4 478 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)I 22a_100000211102_100000032414 [0,1,1,0,0,0|2,0,0]=4 479 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)I 527a_100000211102_100000032414 [0,1,1,0,0,0|2,0,0]=4 480 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)O 1626a_100000210217_100000032414 [0,1,1,0,0,0|2,0,0]=4 481 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)O 22a_100000210217_100000032414 [0,1,1,0,0,0|2,0,0]=4 482 B19R2.3420 O=Ic1ccccc1C(=O)Nc2cccc(c2)O 527a_100000210217_100000032414 [0,1,1,0,0,0|2,0,0]=4 483 B19R2.3669 CCc1c(cccc1C(=O)Cc2ccccc2)Br 1458a_100010125490_100015291786 [0,1,1,0,0,0|1,0,1]=4 484 B19R2.3669 COc1c(cccc1C(=O)Cc2ccccc2)Br 1458a_100000689802_100015291786 [0,1,1,0,0,0|2,0,0]=4 485 B19R2.3669 COc1c(cccc1C(=O)Cc2ccccc2)C 1458a_100000187929_100015291786 [0,1,1,0,0,0|2,0,0]=4 486 B19R2.3669 COc1c(cccc1C(=O)Cc2ccccc2)Cl 1458a_100011934004_100015291786 [0,1,1,0,0,0|2,0,0]=4 487 B19R2.3669 COc1c(cccc1C(=O)Cc2ccccc2)F 1458a_100011218433_100015291786 [0,1,1,0,0,0|2,0,0]=4 488 B19R2.3669 COc1c(cccc1C(=O)Cc2ccccc2)O 1458a_100000080799_100015291786 [0,1,1,0,0,0|2,0,0]=4 489 B19R2.3669 N#Cc1c(cccc1C(=O)Cc2ccccc2)F 1458a_100000702252_100015291786 [0,1,1,0,0,0|1,0,1]=4 490 B19R2.8825 CC(=O)c1ccccc1C(=O)Nc2ccccc2 1458a_100000014567_200000210301 [0,1,1,0,0,0|1,0,0]=3 491 B19R2.8825 CC(C)c1ccccc1C(=O)Cc2ccccc2 1458a_100011941426_100015291786 [0,1,1,0,0,0|1,0,1]=4 492 B19R2.8825 CN(C)c1ccccc1C(=O)Cc2ccccc2 1458a_100011218752_100015291786 [0,1,1,0,0,0|2,0,0]=4 493 B19R2.8825 CN(Cc1ccccc1)c2ccccc2C(=O)N 269982a_100000184419_100000211182 [0,1,1,0,0,0|2,0,0]=4 494 B19R2.8825 CN(Cc1ccccc1)c2ccccc2C(=O)O 269956a_100011217277_200000210301 [0,1,1,0,0,0|2,0,0]=4 495 B19R2.8825 CS(=O)c1ccccc1C(=O)Cc2ccccc2 1458a_100000204632_100015291786 [0,1,1,0,0,0|1,0,0]=3 496 B19R2.8825 CS(=O)c1ccccc1C(=O)Cc2ccccn2 1458a_100000204632_100000721315 [0,1,1,0,0,0|2,0,0]=4 497 B19R2.8825 CS(=O)c1ccccc1C(=O)Cc2cccnc2 1458a_100000204632_100000733263 [0,1,1,0,0,0|2,0,0]=4 498 B19R2.8825 CS(=O)c1ccccc1C(=O)Cc2ccncc2 1458a_100000204632_100000705612 [0,1,1,0,0,0|2,0,0]=4 499 B19R2.8825 CS(=O)c1ccccc1C(=O)Nc2ccccc2 1626a_100000106764_100000204632 [0,1,1,0,0,0|2,0,0]=4 500 B19R2.8825 CS(=O)c1ccccc1C(=O)Nc2ccccc2 22a_100000106764_100000204632 [0,1,1,0,0,0|2,0,0]=4 501 B19R2.8825 O=C(Cc1ccccc1)c2ccccc2C(F)F 1458a_100009872251_100015291786 [0,1,1,0,0,0|1,0,1]=4 502 B19R2.8825 O=C(Cc1ccccc1)c2ccccc2I(=O)=O 1458a_100000061294_100015291786 [0,1,1,0,0,0|1,0,0]=3 503 B19R2.8825 O=C(Cc1ccccc1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100015291786 [0,1,1,0,0,0|1,0,0]=3 504 B19R2.8825 O=C(Cc1ccccn1)c2ccccc2I(=O)=O 1458a_100000061294_100000721315 [0,1,1,0,0,0|2,0,0]=4 505 B19R2.8825 O=C(Cc1ccccn1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000721315 [0,1,1,0,0,0|2,0,0]=4 506 B19R2.8825 O=C(Cc1cccnc1)c2ccccc2I(=O)=O 1458a_100000061294_100000733263 [0,1,1,0,0,0|2,0,0]=4 507 B19R2.8825 O=C(Cc1cccnc1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000733263 [0,1,1,0,0,0|2,0,0]=4 508 B19R2.8825 O=C(Cc1ccncc1)c2ccccc2I(=O)=O 1458a_100000061294_100000705612 [0,1,1,0,0,0|2,0,0]=4 509 B19R2.8825 O=C(Cc1ccncc1)c2ccccc2[N+](=O)[O-] 1458a_100000188706_100000705612 [0,1,1,0,0,0|2,0,0]=4 510 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2I(=O)=O 1626a_100000106764_100000061294 [0,1,1,0,0,0|2,0,0]=4 511 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2I(=O)=O 22a_100000106764_100000061294 [0,1,1,0,0,0|2,0,0]=4 512 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2[N+](=O)[O-] 11a_100000106764_100000188706 [0,1,1,0,0,0|2,0,0]=4 513 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2[N+](=O)[O-] 1626a_100000106764_100000188706 [0,1,1,0,0,0|2,0,0]=4 514 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2[N+](=O)[O-] 22a_100000106764_100000188706 [0,1,1,0,0,0|2,0,0]=4 515 B19R2.8825 O=C(Nc1ccccc1)c2ccccc2[N+](=O)[O-] 527a_100000106764_100000188706 [0,1,1,0,0,0|2,0,0]=4 516 B19R2.8825 [13CH3]C(=O)c1ccccc1C(=O)Nc2ccccc2 1458a_100000014567_200025704644 [0,1,1,0,0,0|1,0,0]=3 517 B19R2.8825 [13CH3]N(Cc1ccccc1)c2ccccc2C(=O)O 269956a_100011217277_200025704644 [0,1,1,0,0,0|2,0,0]=4 518 B19R2.9439 CCOc1ccccc1C(=O)Cc2ccccc2 1458a_100000211144_100015291786 [0,1,1,0,0,0|1,0,1]=4 519 B19R2.9439 CCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000210202 [0,1,1,0,0,0|1,0,1]=4 520 B19R2.9439 CCSc1ccccc1C(=O)Cc2ccccc2 1458a_100000195471_100015291786 [0,1,1,0,0,0|1,0,1]=4 521 B19R2.9439 COCc1ccccc1C(=O)Cc2ccccc2 1458a_100000737999_100015291786 [0,1,1,0,0,0|0,0,2]=4 522 B19R2.9439 N#CCc1ccccc1C(=O)Cc2ccccc2 1458a_100000010604_100015291786 [0,1,1,0,0,0|1,0,1]=4 523 B19R2.9439 O=C(Cc1ccccc1)c2ccccc2OCF 7a_100000040333_100015361967 [0,1,1,0,0,0|1,0,1]=4 524 B19R2.9439 [N-]=[N+]=Nc1ccccc1C(=O)Cc2ccccc2 1458a_100009827904_100015291786 [0,1,1,0,0,0|2,0,0]=4 525 B19R2.29259 C#Cc1ccccc1C(=O)Cc2ccccc2Br 1458a_100011243808_100000184730 [0,1,1,0,0,0|1,0,1]=4 526 B19R2.29259 C#Cc1ccccc1C(=O)Cc2ccccc2C 1458a_100011243808_100000211839 [0,1,1,0,0,0|1,0,1]=4 527 B19R2.29259 C#Cc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100011243808_100000187162 [0,1,1,0,0,0|1,0,1]=4 528 B19R2.29259 C#Cc1ccccc1C(=O)Cc2ccccc2F 1458a_100011243808_100000187165 [0,1,1,0,0,0|1,0,1]=4 529 B19R2.29259 C#Cc1ccccc1C(=O)Cc2ccccc2I 1458a_100011243808_100011216222 [0,1,1,0,0,0|1,0,1]=4 530 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccccc2Br 1458a_100011830265_100000184730 [0,1,1,0,0,0|1,0,0]=3 531 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccccc2C 1458a_100011830265_100000211839 [0,1,1,0,0,0|1,0,0]=3 532 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100011830265_100000187162 [0,1,1,0,0,0|1,0,0]=3 533 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccccc2F 1458a_100011830265_100000187165 [0,1,1,0,0,0|1,0,0]=3 534 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccccc2I 1458a_100011830265_100011216222 [0,1,1,0,0,0|1,0,0]=3 535 B19R2.29259 C=Cc1ccccc1C(=O)Cc2cccnc2Br 1458a_100011830265_100010140945 [0,1,1,0,0,0|2,0,0]=4 536 B19R2.29259 C=Cc1ccccc1C(=O)Cc2cccnc2C 1458a_100011830265_100000732876 [0,1,1,0,0,0|2,0,0]=4 537 B19R2.29259 C=Cc1ccccc1C(=O)Cc2cccnc2Cl 1458a_100011830265_100000045678 [0,1,1,0,0,0|2,0,0]=4 538 B19R2.29259 C=Cc1ccccc1C(=O)Cc2cccnc2F 1458a_100011830265_100000099810 [0,1,1,0,0,0|2,0,0]=4 539 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccncc2C 1458a_100011830265_100020672808 [0,1,1,0,0,0|2,0,0]=4 540 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ccncc2Cl 1458a_100011830265_100000763264 [0,1,1,0,0,0|2,0,0]=4 541 B19R2.29259 C=Cc1ccccc1C(=O)Cc2cnccc2C 1458a_100011830265_100000690890 [0,1,1,0,0,0|2,0,0]=4 542 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ncccc2Br 1458a_100011830265_100025702911 [0,1,1,0,0,0|2,0,0]=4 543 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ncccc2C 1458a_100011830265_100000696600 [0,1,1,0,0,0|2,0,0]=4 544 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ncccc2Cl 1458a_100011830265_100000099807 [0,1,1,0,0,0|2,0,0]=4 545 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ncccc2F 1458a_100011830265_100000104219 [0,1,1,0,0,0|2,0,0]=4 546 B19R2.29259 C=Cc1ccccc1C(=O)Cc2ncccc2O 1458a_100011830265_200020655725 [0,1,1,0,0,0|2,0,0]=4 547 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2Br 1626a_100000210017_100011830265 [0,1,1,0,0,0|2,0,0]=4 548 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2C 1626a_100015192222_100011830265 [0,1,1,0,0,0|2,0,0]=4 549 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2C 22a_100015192222_100011830265 [0,1,1,0,0,0|2,0,0]=4 550 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2C 271570a_100011290941_200015278498 [0,1,1,0,0,0|2,0,0]=4 551 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2Cl 1626a_100000185783_100011830265 [0,1,1,0,0,0|2,0,0]=4 552 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2Cl 22a_100000185783_100011830265 [0,1,1,0,0,0|2,0,0]=4 553 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2F 1626a_100000210422_100011830265 [0,1,1,0,0,0|2,0,0]=4 554 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2F 22a_100000210422_100011830265 [0,1,1,0,0,0|2,0,0]=4 555 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2I 1626a_100000210053_100011830265 [0,1,1,0,0,0|2,0,0]=4 556 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2N 271570a_100011290941_100000511832 [0,1,1,0,0,0|2,0,0]=4 557 B19R2.29259 C=Cc1ccccc1C(=O)Nc2ccccc2O 22a_100000185747_100011830265 [0,1,1,0,0,0|2,0,0]=4 558 B19R2.29259 CCc1ccccc1C(=O)Cc2ccccc2Br 1458a_100000689120_100000184730 [0,1,1,0,0,0|1,0,1]=4 559 B19R2.29259 CCc1ccccc1C(=O)Cc2ccccc2C 1458a_100000689120_100000211839 [0,1,1,0,0,0|1,0,1]=4 560 B19R2.29259 CCc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100000689120_100000187162 [0,1,1,0,0,0|1,0,1]=4 561 B19R2.29259 CCc1ccccc1C(=O)Cc2ccccc2F 1458a_100000689120_100000187165 [0,1,1,0,0,0|1,0,1]=4 562 B19R2.29259 CCc1ccccc1C(=O)Cc2ccccc2I 1458a_100000689120_100011216222 [0,1,1,0,0,0|1,0,1]=4 563 B19R2.29259 COc1ccccc1C(=O)Cc2ccccc2Br 1458a_100000185835_100000184730 [0,1,1,0,0,0|2,0,0]=4 564 B19R2.29259 COc1ccccc1C(=O)Cc2ccccc2C 1458a_100000185835_100000211839 [0,1,1,0,0,0|2,0,0]=4 565 B19R2.29259 COc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100000185835_100000187162 [0,1,1,0,0,0|2,0,0]=4 566 B19R2.29259 COc1ccccc1C(=O)Cc2ccccc2F 1458a_100000185835_100000187165 [0,1,1,0,0,0|2,0,0]=4 567 B19R2.29259 COc1ccccc1C(=O)Cc2ccccc2I 1458a_100000185835_100011216222 [0,1,1,0,0,0|2,0,0]=4 568 B19R2.29259 CSc1ccccc1C(=O)Cc2ccccc2Br 1458a_100000183967_100000184730 [0,1,1,0,0,0|2,0,0]=4 569 B19R2.29259 CSc1ccccc1C(=O)Cc2ccccc2C 1458a_100000183967_100000211839 [0,1,1,0,0,0|2,0,0]=4 570 B19R2.29259 CSc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100000183967_100000187162 [0,1,1,0,0,0|2,0,0]=4 571 B19R2.29259 CSc1ccccc1C(=O)Cc2ccccc2F 1458a_100000183967_100000187165 [0,1,1,0,0,0|2,0,0]=4 572 B19R2.29259 CSc1ccccc1C(=O)Cc2ccccc2I 1458a_100000183967_100011216222 [0,1,1,0,0,0|2,0,0]=4 573 B19R2.29259 Cc1ccccc1CC(=O)c2ccccc2C#N 1458a_100000742908_100000211839 [0,1,1,0,0,0|1,0,1]=4 574 B19R2.29259 Cc1ccccc1CC(=O)c2ccccc2CO 1458a_100011301526_100000211839 [0,1,1,0,0,0|0,0,2]=4 575 B19R2.29259 Cc1ccccc1CC(=O)c2ccccc2I=O 1458a_100000032414_100000211839 [0,1,1,0,0,0|1,0,0]=3 576 B19R2.29259 Cc1ccccc1NC(=O)c2ccccc2I=O 1626a_100015192222_100000032414 [0,1,1,0,0,0|2,0,0]=4 577 B19R2.29259 Cc1ccccc1NC(=O)c2ccccc2I=O 22a_100015192222_100000032414 [0,1,1,0,0,0|2,0,0]=4 578 B19R2.29259 Cc1ccccc1NC(=O)c2ccccc2I=O 527a_100015192222_100000032414 [0,1,1,0,0,0|2,0,0]=4 579 B19R2.29259 Cc1cccnc1CC(=O)c2ccccc2I=O 1458a_100000032414_100000696600 [0,1,1,0,0,0|2,0,0]=4 580 B19R2.29259 Cc1ccncc1CC(=O)c2ccccc2I=O 1458a_100000032414_100000690890 [0,1,1,0,0,0|2,0,0]=4 581 B19R2.29259 Cc1cnccc1CC(=O)c2ccccc2I=O 1458a_100000032414_100020672808 [0,1,1,0,0,0|2,0,0]=4 582 B19R2.29259 Cc1ncccc1CC(=O)c2ccccc2I=O 1458a_100000032414_100000732876 [0,1,1,0,0,0|2,0,0]=4 583 B19R2.29259 N#Cc1ccccc1C(=O)Cc2ccccc2Br 1458a_100000742908_100000184730 [0,1,1,0,0,0|1,0,1]=4 584 B19R2.29259 N#Cc1ccccc1C(=O)Cc2ccccc2Cl 1458a_100000742908_100000187162 [0,1,1,0,0,0|1,0,1]=4 585 B19R2.29259 N#Cc1ccccc1C(=O)Cc2ccccc2F 1458a_100000742908_100000187165 [0,1,1,0,0,0|1,0,1]=4 586 B19R2.29259 N#Cc1ccccc1C(=O)Cc2ccccc2I 1458a_100000742908_100011216222 [0,1,1,0,0,0|1,0,1]=4 587 B19R2.29259 O=C(Cc1ccccc1Br)c2ccccc2CO 1458a_100011301526_100000184730 [0,1,1,0,0,0|0,0,2]=4 588 B19R2.29259 O=C(Cc1ccccc1Cl)c2ccccc2CO 1458a_100011301526_100000187162 [0,1,1,0,0,0|0,0,2]=4 589 B19R2.29259 O=C(Cc1ccccc1F)c2ccccc2CO 1458a_100011301526_100000187165 [0,1,1,0,0,0|0,0,2]=4 590 B19R2.29259 O=C(Cc1ccccc1I)c2ccccc2CO 1458a_100011301526_100011216222 [0,1,1,0,0,0|0,0,2]=4 591 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ccccc2Br 1458a_100000032414_100000184730 [0,1,1,0,0,0|1,0,0]=3 592 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ccccc2Cl 1458a_100000032414_100000187162 [0,1,1,0,0,0|1,0,0]=3 593 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ccccc2F 1458a_100000032414_100000187165 [0,1,1,0,0,0|1,0,0]=3 594 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ccccc2I 1458a_100000032414_100011216222 [0,1,1,0,0,0|1,0,0]=3 595 B19R2.29259 O=Ic1ccccc1C(=O)Cc2cccnc2Br 1458a_100000032414_100010140945 [0,1,1,0,0,0|2,0,0]=4 596 B19R2.29259 O=Ic1ccccc1C(=O)Cc2cccnc2Cl 1458a_100000032414_100000045678 [0,1,1,0,0,0|2,0,0]=4 597 B19R2.29259 O=Ic1ccccc1C(=O)Cc2cccnc2F 1458a_100000032414_100000099810 [0,1,1,0,0,0|2,0,0]=4 598 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ccncc2Cl 1458a_100000032414_100000763264 [0,1,1,0,0,0|2,0,0]=4 599 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ncccc2Br 1458a_100000032414_100025702911 [0,1,1,0,0,0|2,0,0]=4 600 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ncccc2Cl 1458a_100000032414_100000099807 [0,1,1,0,0,0|2,0,0]=4 601 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ncccc2F 1458a_100000032414_100000104219 [0,1,1,0,0,0|2,0,0]=4 602 B19R2.29259 O=Ic1ccccc1C(=O)Cc2ncccc2O 1458a_100000032414_200020655725 [0,1,1,0,0,0|2,0,0]=4 603 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2Br 1626a_100000210017_100000032414 [0,1,1,0,0,0|2,0,0]=4 604 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2Cl 1626a_100000185783_100000032414 [0,1,1,0,0,0|2,0,0]=4 605 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2Cl 22a_100000185783_100000032414 [0,1,1,0,0,0|2,0,0]=4 606 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2Cl 527a_100000185783_100000032414 [0,1,1,0,0,0|2,0,0]=4 607 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2F 1626a_100000210422_100000032414 [0,1,1,0,0,0|2,0,0]=4 608 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2F 22a_100000210422_100000032414 [0,1,1,0,0,0|2,0,0]=4 609 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2F 527a_100000210422_100000032414 [0,1,1,0,0,0|2,0,0]=4 610 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2I 1626a_100000210053_100000032414 [0,1,1,0,0,0|2,0,0]=4 611 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2O 22a_100000185747_100000032414 [0,1,1,0,0,0|2,0,0]=4 612 B19R2.29259 O=Ic1ccccc1C(=O)Nc2ccccc2O 527a_100000185747_100000032414 [0,1,1,0,0,0|2,0,0]=4 613 B19R2.1103208 C=CCN(CC=C)C1C(=O)c2ccccc2C1=O 2230a_100000210471_200009813996 [0,1,1,0,0,0|1,0,1]=4 614 B19R2.1103208 C=CCN(CC=C)C1C(=O)c2ccccc2C1=O 269982a_100000210471_200009813996 [0,1,1,0,0,0|1,0,1]=4 615 B19R2.1678105 C=CC=CC(=O)CN1C(=O)c2ccccc2C1=O 1458a_100016291481_100000211781 [0,1,1,0,0,0|1,0,1]=4 616 B21R3.144871 Cc1ccc(cc1)SC2C(=O)c3ccccc3C2=O 62a_100000186775_200009813996 [0,1,0,0,0,1|0,0,0]=2 617 B21R3.144871 Cc1ccc(cc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000186775 [0,1,0,0,0,1|0,0,0]=2 618 B21R3.144871 Cc1ccc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100000751577_200009813996 [0,1,0,0,0,1|1,0,0]=3 619 B21R3.144871 Cc1ccc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000751577 [0,1,0,0,0,1|1,0,0]=3 620 B21R3.144871 Cc1ccc(nc1)SC2C(=O)c3ccccc3C2=O 62a_100011192072_200009813996 [0,1,0,0,0,1|1,0,0]=3 621 B21R3.144871 Cc1ccc(nc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000754016 [0,1,0,0,0,1|1,0,0]=3 622 B21R3.144871 Cc1ccc(nn1)SC2C(=O)c3ccccc3C2=O 62a_100000744512_200009813996 [0,1,0,0,0,1|2,0,0]=4 623 B21R3.144871 Cc1ccc(nn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000744512 [0,1,0,0,0,1|2,0,0]=4 624 B21R3.144871 Cc1cnc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100011999403_200009813996 [0,1,0,0,0,1|2,0,0]=4 625 B21R3.144871 Cc1cnc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011999403 [0,1,0,0,0,1|2,0,0]=4 626 B21R3.144871 Cc1cnc(nc1)SC2C(=O)c3ccccc3C2=O 62a_100000061069_200009813996 [0,1,0,0,0,1|2,0,0]=4 627 B21R3.144871 Cc1cnc(nc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000061069 [0,1,0,0,0,1|2,0,0]=4 628 B21R3.144871 Cc1ncc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100000686985_200009813996 [0,1,0,0,0,1|2,0,0]=4 629 B21R3.144871 Cc1ncc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000686985 [0,1,0,0,0,1|2,0,0]=4 630 B21R3.144871 Nc1ccc(cc1)SC2C(=O)c3ccccc3C2=O 62a_100000185761_200009813996 [0,1,0,0,0,1|0,0,0]=2 631 B21R3.144871 Nc1ccc(cc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000185761 [0,1,0,0,0,1|0,0,0]=2 632 B21R3.144871 Nc1ccc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100000187370_200009813996 [0,1,0,0,0,1|1,0,0]=3 633 B21R3.144871 Nc1ccc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000187370 [0,1,0,0,0,1|1,0,0]=3 634 B21R3.144871 Nc1ccc(nc1)SC2C(=O)c3ccccc3C2=O 62a_100000737798_200009813996 [0,1,0,0,0,1|1,0,0]=3 635 B21R3.144871 Nc1ccc(nc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000737798 [0,1,0,0,0,1|1,0,0]=3 636 B21R3.144871 Nc1ccc(nn1)SC2C(=O)c3ccccc3C2=O 62a_100010219413_200009813996 [0,1,0,0,0,1|2,0,0]=4 637 B21R3.144871 Nc1ccc(nn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100010219413 [0,1,0,0,0,1|2,0,0]=4 638 B21R3.144871 Nc1cnc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100000744751_200009813996 [0,1,0,0,0,1|2,0,0]=4 639 B21R3.144871 Nc1cnc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000744751 [0,1,0,0,0,1|2,0,0]=4 640 B21R3.144871 Nc1cnc(nc1)SC2C(=O)c3ccccc3C2=O 62a_100000068403_200009813996 [0,1,0,0,0,1|2,0,0]=4 641 B21R3.144871 Nc1cnc(nc1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000068403 [0,1,0,0,0,1|2,0,0]=4 642 B21R3.144871 Nc1ncc(cn1)SC2C(=O)c3ccccc3C2=O 62a_100000766020_200009813996 [0,1,0,0,0,1|2,0,0]=4 643 B21R3.144871 Nc1ncc(cn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000766020 [0,1,0,0,0,1|2,0,0]=4 644 B21R3.144871 O=C1c2ccccc2C(=O)C1Nc3ccc(cc3)Br 2230a_100000210018_200009813996 [0,1,0,0,0,1|0,0,0]=2 645 B21R3.144871 O=C1c2ccccc2C(=O)C1Nc3ccc(cc3)Cl 2230a_100000210052_200009813996 [0,1,0,0,0,1|0,0,0]=2 646 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cc[n+](cc3)[O-] 62a_200009813996_100000039755 [0,1,0,0,0,1|1,0,0]=3 647 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(=O)[nH]c3 62a_100000212171_200009813996 [0,1,0,0,0,1|1,0,0]=3 648 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(=O)[nH]c3 62a_200009813996_100000212171 [0,1,0,0,0,1|1,0,0]=3 649 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(=O)[nH]n3 62a_100009820020_200009813996 [0,1,0,0,0,1|2,0,0]=4 650 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(=O)[nH]n3 62a_200009813996_100009820020 [0,1,0,0,0,1|2,0,0]=4 651 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)Br 62a_100000752885_200009813996 [0,1,0,0,0,1|0,0,0]=2 652 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)Br 62a_200009813996_100000752885 [0,1,0,0,0,1|0,0,0]=2 653 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)Cl 62a_100000755918_200009813996 [0,1,0,0,0,1|0,0,0]=2 654 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)Cl 62a_200009813996_100000755918 [0,1,0,0,0,1|0,0,0]=2 655 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)F 62a_100000211213_200009813996 [0,1,0,0,0,1|0,0,0]=2 656 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)F 62a_200009813996_100000211213 [0,1,0,0,0,1|0,0,0]=2 657 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cc3)O 62a_200009813996_100000185759 [0,1,0,0,0,1|0,0,0]=2 658 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)Br 62a_100000686858_200009813996 [0,1,0,0,0,1|1,0,0]=3 659 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)Br 62a_200009813996_100000686858 [0,1,0,0,0,1|1,0,0]=3 660 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)Cl 62a_100011356976_200009813996 [0,1,0,0,0,1|1,0,0]=3 661 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)Cl 62a_200009813996_100011356976 [0,1,0,0,0,1|1,0,0]=3 662 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)F 62a_100000744514_200009813996 [0,1,0,0,0,1|1,0,0]=3 663 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)F 62a_200009813996_100000744514 [0,1,0,0,0,1|1,0,0]=3 664 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)O 62a_100000685995_200009813996 [0,1,0,0,0,1|1,0,0]=3 665 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(cn3)O 62a_200009813996_100000744096 [0,1,0,0,0,1|1,0,0]=3 666 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)Br 62a_100009814638_200009813996 [0,1,0,0,0,1|1,0,0]=3 667 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)Br 62a_200009813996_100009814638 [0,1,0,0,0,1|1,0,0]=3 668 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)Cl 62a_100000034144_200009813996 [0,1,0,0,0,1|1,0,0]=3 669 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)Cl 62a_200009813996_100000034144 [0,1,0,0,0,1|1,0,0]=3 670 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)F 62a_100000042367_200009813996 [0,1,0,0,0,1|1,0,0]=3 671 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nc3)F 62a_200009813996_100000042367 [0,1,0,0,0,1|1,0,0]=3 672 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nn3)Cl 62a_100000068654_200009813996 [0,1,0,0,0,1|2,0,0]=4 673 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ccc(nn3)Cl 62a_200009813996_100000068654 [0,1,0,0,0,1|2,0,0]=4 674 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(=O)[nH]c3 62a_102495366499_200009813996 [0,1,0,0,0,1|2,0,0]=4 675 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(=O)[nH]c3 62a_200009813996_102495366499 [0,1,0,0,0,1|2,0,0]=4 676 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)Br 62a_100010187541_200009813996 [0,1,0,0,0,1|2,0,0]=4 677 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)Br 62a_200009813996_100010187541 [0,1,0,0,0,1|2,0,0]=4 678 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)Cl 62a_100010214907_200009813996 [0,1,0,0,0,1|2,0,0]=4 679 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)Cl 62a_200009813996_100010214907 [0,1,0,0,0,1|2,0,0]=4 680 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)F 62a_100009856528_200009813996 [0,1,0,0,0,1|2,0,0]=4 681 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)F 62a_200009813996_100009856528 [0,1,0,0,0,1|2,0,0]=4 682 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)O 62a_100011934580_200009813996 [0,1,0,0,0,1|2,0,0]=4 683 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(cn3)O 62a_200009813996_100015839800 [0,1,0,0,0,1|2,0,0]=4 684 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)Br 62a_200009813996_200012349914 [0,1,0,0,0,1|2,0,0]=4 685 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)Br 62a_200012349914_200009813996 [0,1,0,0,0,1|2,0,0]=4 686 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)Cl 62a_100000059775_200009813996 [0,1,0,0,0,1|2,0,0]=4 687 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)Cl 62a_200009813996_100000059775 [0,1,0,0,0,1|2,0,0]=4 688 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)F 62a_100000685262_200009813996 [0,1,0,0,0,1|2,0,0]=4 689 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3cnc(nc3)F 62a_200009813996_100000685262 [0,1,0,0,0,1|2,0,0]=4 690 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)Br 62a_100000690281_200009813996 [0,1,0,0,0,1|2,0,0]=4 691 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)Br 62a_200009813996_100000690281 [0,1,0,0,0,1|2,0,0]=4 692 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)Cl 62a_100011356929_200009813996 [0,1,0,0,0,1|2,0,0]=4 693 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)Cl 62a_200009813996_100011356929 [0,1,0,0,0,1|2,0,0]=4 694 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)F 62a_100000685220_200009813996 [0,1,0,0,0,1|2,0,0]=4 695 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)F 62a_200009813996_100000685220 [0,1,0,0,0,1|2,0,0]=4 696 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)O 62a_100000730009_200009813996 [0,1,0,0,0,1|2,0,0]=4 697 B21R3.144871 O=C1c2ccccc2C(=O)C1Sc3ncc(cn3)O 62a_200009813996_100000092845 [0,1,0,0,0,1|2,0,0]=4 698 B21R3.144871 O=C1c2ccccc2C(=O)N1Cc3ccc(nc3)O 271570a_203496583355_200000516857 [0,1,0,0,0,1|2,0,0]=4 699 B21R3.151125 C[n+]1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_100009996589_200009813996 [0,1,0,0,0,1|1,0,0]=3 700 B21R3.151125 C[n+]1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100009996589 [0,1,0,0,0,1|1,0,0]=3 701 B21R3.151125 Cc1cc(ccn1)SC2C(=O)c3ccccc3C2=O 62a_100000758586_200009813996 [0,1,0,0,0,1|1,0,0]=3 702 B21R3.151125 Cc1cc(ccn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000758586 [0,1,0,0,0,1|1,0,0]=3 703 B21R3.151125 Cc1cc(ncn1)SC2C(=O)c3ccccc3C2=O 62a_100000744208_200009813996 [0,1,0,0,0,1|2,0,0]=4 704 B21R3.151125 Cc1cc(ncn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000744208 [0,1,0,0,0,1|2,0,0]=4 705 B21R3.151125 Cc1cccc(c1)NC2C(=O)c3ccccc3C2=O 2230a_100000188690_200009813996 [0,1,0,0,0,1|0,0,0]=2 706 B21R3.151125 Cc1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_100011215228_200009813996 [0,1,0,0,0,1|0,0,0]=2 707 B21R3.151125 Cc1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011215228 [0,1,0,0,0,1|0,0,0]=2 708 B21R3.151125 Cc1cccc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000742759_200009813996 [0,1,0,0,0,1|1,0,0]=3 709 B21R3.151125 Cc1cccc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000742759 [0,1,0,0,0,1|1,0,0]=3 710 B21R3.151125 Cc1ccnc(c1)SC2C(=O)c3ccccc3C2=O 62a_100000750283_200009813996 [0,1,0,0,0,1|1,0,0]=3 711 B21R3.151125 Cc1ccnc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000750283 [0,1,0,0,0,1|1,0,0]=3 712 B21R3.151125 Cc1ccnc(n1)SC2C(=O)c3ccccc3C2=O 62a_100011243806_200009813996 [0,1,0,0,0,1|2,0,0]=4 713 B21R3.151125 Cc1ccnc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011243806 [0,1,0,0,0,1|2,0,0]=4 714 B21R3.151125 Cc1cncc(c1)SC2C(=O)c3ccccc3C2=O 62a_100000760492_200009813996 [0,1,0,0,0,1|1,0,0]=3 715 B21R3.151125 Cc1cncc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000760492 [0,1,0,0,0,1|1,0,0]=3 716 B21R3.151125 Cc1cncc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000754123_200009813996 [0,1,0,0,0,1|2,0,0]=4 717 B21R3.151125 Cc1cncc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000754123 [0,1,0,0,0,1|2,0,0]=4 718 B21R3.151125 Cc1cnnc(c1)SC2C(=O)c3ccccc3C2=O 62a_100000070100_200009813996 [0,1,0,0,0,1|2,0,0]=4 719 B21R3.151125 Cc1cnnc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000070100 [0,1,0,0,0,1|2,0,0]=4 720 B21R3.151125 Cc1nccc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000749937_200009813996 [0,1,0,0,0,1|2,0,0]=4 721 B21R3.151125 Cc1nccc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000749937 [0,1,0,0,0,1|2,0,0]=4 722 B21R3.151125 Nc1cc(ccn1)SC2C(=O)c3ccccc3C2=O 62a_100000049665_200009813996 [0,1,0,0,0,1|1,0,0]=3 723 B21R3.151125 Nc1cc(ccn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000049665 [0,1,0,0,0,1|1,0,0]=3 724 B21R3.151125 Nc1cc(cnn1)SC2C(=O)c3ccccc3C2=O 62a_100000130277_200009813996 [0,1,0,0,0,1|2,0,0]=4 725 B21R3.151125 Nc1cc(cnn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000130277 [0,1,0,0,0,1|2,0,0]=4 726 B21R3.151125 Nc1cc(ncn1)SC2C(=O)c3ccccc3C2=O 62a_100000701291_200009813996 [0,1,0,0,0,1|2,0,0]=4 727 B21R3.151125 Nc1cc(ncn1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000701291 [0,1,0,0,0,1|2,0,0]=4 728 B21R3.151125 Nc1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_100000210019_200009813996 [0,1,0,0,0,1|0,0,0]=2 729 B21R3.151125 Nc1cccc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000210019 [0,1,0,0,0,1|0,0,0]=2 730 B21R3.151125 Nc1cccc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000740741_200009813996 [0,1,0,0,0,1|1,0,0]=3 731 B21R3.151125 Nc1cccc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000740741 [0,1,0,0,0,1|1,0,0]=3 732 B21R3.151125 Nc1ccnc(c1)SC2C(=O)c3ccccc3C2=O 62a_100009814236_200009813996 [0,1,0,0,0,1|1,0,0]=3 733 B21R3.151125 Nc1ccnc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100009814236 [0,1,0,0,0,1|1,0,0]=3 734 B21R3.151125 Nc1ccnc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000757536_200009813996 [0,1,0,0,0,1|2,0,0]=4 735 B21R3.151125 Nc1ccnc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000757536 [0,1,0,0,0,1|2,0,0]=4 736 B21R3.151125 Nc1cncc(c1)SC2C(=O)c3ccccc3C2=O 62a_100000687067_200009813996 [0,1,0,0,0,1|1,0,0]=3 737 B21R3.151125 Nc1cncc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000687067 [0,1,0,0,0,1|1,0,0]=3 738 B21R3.151125 Nc1cncc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000747728_200009813996 [0,1,0,0,0,1|2,0,0]=4 739 B21R3.151125 Nc1cncc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000747728 [0,1,0,0,0,1|2,0,0]=4 740 B21R3.151125 Nc1cnnc(c1)SC2C(=O)c3ccccc3C2=O 62a_100011996757_200009813996 [0,1,0,0,0,1|2,0,0]=4 741 B21R3.151125 Nc1cnnc(c1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011996757 [0,1,0,0,0,1|2,0,0]=4 742 B21R3.151125 Nc1nccc(n1)SC2C(=O)c3ccccc3C2=O 62a_100000055538_200009813996 [0,1,0,0,0,1|2,0,0]=4 743 B21R3.151125 Nc1nccc(n1)SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000055538 [0,1,0,0,0,1|2,0,0]=4 744 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3c[n+](ccn3)[O-] 62a_200009813996_100009880115 [0,1,0,0,0,1|2,0,0]=4 745 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(=O)[nH]cn3 62a_100012002517_200009813996 [0,1,0,0,0,1|2,0,0]=4 746 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(=O)cc[nH]3 62a_100009817434_200009813996 [0,1,0,0,0,1|1,0,0]=3 747 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ccn3)Cl 62a_100010167805_200009813996 [0,1,0,0,0,1|1,0,0]=3 748 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ccn3)Cl 62a_200009813996_100010167805 [0,1,0,0,0,1|1,0,0]=3 749 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ccn3)F 62a_100000764206_200009813996 [0,1,0,0,0,1|1,0,0]=3 750 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ccn3)F 62a_200009813996_100000764206 [0,1,0,0,0,1|1,0,0]=3 751 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ccn3)O 62a_200009813996_100000762945 [0,1,0,0,0,1|1,0,0]=3 752 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(cnn3)O 62a_200009813996_200010734679 [0,1,0,0,0,1|2,0,0]=4 753 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ncn3)Cl 62a_100010161198_200009813996 [0,1,0,0,0,1|2,0,0]=4 754 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ncn3)Cl 62a_200009813996_100010161198 [0,1,0,0,0,1|2,0,0]=4 755 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ncn3)F 62a_200009813996_200009880791 [0,1,0,0,0,1|2,0,0]=4 756 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ncn3)F 62a_200009880791_200009813996 [0,1,0,0,0,1|2,0,0]=4 757 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc(ncn3)O 62a_200009813996_100000765262 [0,1,0,0,0,1|2,0,0]=4 758 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc[nH]c(=O)c3 62a_100009816521_200009813996 [0,1,0,0,0,1|1,0,0]=3 759 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc[nH]c(=O)c3 62a_200009813996_100009816521 [0,1,0,0,0,1|1,0,0]=3 760 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cc[nH]c(=O)n3 62a_200009813996_200000134032 [0,1,0,0,0,1|2,0,0]=4 761 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccc[n+](c3)[O-] 62a_200009813996_100009815978 [0,1,0,0,0,1|1,0,0]=3 762 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(=O)[nH]3 62a_200009813996_100000752884 [0,1,0,0,0,1|1,0,0]=3 763 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)Br 62a_100000691529_200009813996 [0,1,0,0,0,1|0,0,0]=2 764 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)Br 62a_200009813996_100000691529 [0,1,0,0,0,1|0,0,0]=2 765 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)Cl 62a_100000699651_200009813996 [0,1,0,0,0,1|0,0,0]=2 766 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)Cl 62a_200009813996_100000699651 [0,1,0,0,0,1|0,0,0]=2 767 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)F 62a_100000685547_200009813996 [0,1,0,0,0,1|0,0,0]=2 768 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)F 62a_200009813996_100000685547 [0,1,0,0,0,1|0,0,0]=2 769 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)O 62a_200009813996_100000211634 [0,1,0,0,0,1|0,0,0]=2 770 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)[S] 62a_114929384022_200009813996 [0,1,0,0,0,1|0,0,0]=2 771 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(c3)[S] 62a_200009813996_114929384022 [0,1,0,0,0,1|0,0,0]=2 772 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)Br 62a_100000684672_200009813996 [0,1,0,0,0,1|1,0,0]=3 773 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)Br 62a_200009813996_100000684672 [0,1,0,0,0,1|1,0,0]=3 774 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)Cl 62a_100000051397_200009813996 [0,1,0,0,0,1|1,0,0]=3 775 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)Cl 62a_200009813996_100000051397 [0,1,0,0,0,1|1,0,0]=3 776 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)F 62a_100009815982_200009813996 [0,1,0,0,0,1|1,0,0]=3 777 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cccc(n3)F 62a_200009813996_100009815982 [0,1,0,0,0,1|1,0,0]=3 778 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)Br 62a_100009814637_200009813996 [0,1,0,0,0,1|1,0,0]=3 779 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)Br 62a_200009813996_100009814637 [0,1,0,0,0,1|1,0,0]=3 780 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)Cl 62a_100000035001_200009813996 [0,1,0,0,0,1|1,0,0]=3 781 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)Cl 62a_200009813996_100000035001 [0,1,0,0,0,1|1,0,0]=3 782 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)F 62a_100009816116_200009813996 [0,1,0,0,0,1|1,0,0]=3 783 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(c3)F 62a_200009813996_100009816116 [0,1,0,0,0,1|1,0,0]=3 784 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(n3)Cl 62a_100010154678_200009813996 [0,1,0,0,0,1|2,0,0]=4 785 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3ccnc(n3)Cl 62a_200009813996_100010154678 [0,1,0,0,0,1|2,0,0]=4 786 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cn[nH]c(=O)c3 62a_200009813996_100010197405 [0,1,0,0,0,1|2,0,0]=4 787 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)Br 62a_100000728054_200009813996 [0,1,0,0,0,1|1,0,0]=3 788 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)Br 62a_200009813996_100000728054 [0,1,0,0,0,1|1,0,0]=3 789 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)Cl 62a_100000049639_200009813996 [0,1,0,0,0,1|1,0,0]=3 790 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)Cl 62a_200009813996_100000049639 [0,1,0,0,0,1|1,0,0]=3 791 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)F 62a_100000744099_200009813996 [0,1,0,0,0,1|1,0,0]=3 792 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)F 62a_200009813996_100000744099 [0,1,0,0,0,1|1,0,0]=3 793 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)O 62a_100000754920_200009813996 [0,1,0,0,0,1|1,0,0]=3 794 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(c3)O 62a_200009813996_100000754920 [0,1,0,0,0,1|1,0,0]=3 795 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(n3)Cl 62a_100010892449_200009813996 [0,1,0,0,0,1|2,0,0]=4 796 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(n3)Cl 62a_200009813996_100010892449 [0,1,0,0,0,1|2,0,0]=4 797 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(n3)F 62a_200009813996_200009863489 [0,1,0,0,0,1|2,0,0]=4 798 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(n3)F 62a_200009863489_200009813996 [0,1,0,0,0,1|2,0,0]=4 799 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3cncc(n3)O 62a_200009813996_100011269956 [0,1,0,0,0,1|2,0,0]=4 800 B21R3.151125 O=C1c2ccccc2C(=O)C1Sc3nccc(n3)O 62a_200009813996_100011649813 [0,1,0,0,0,1|2,0,0]=4 801 B21R3.217237 C[n+]1ccccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000212160 [0,1,0,0,0,1|1,0,0]=3 802 B21R3.217237 Cc1ccccc1SC2C(=O)c3ccccc3C2=O 62a_100000210755_200009813996 [0,1,0,0,0,1|0,0,0]=2 803 B21R3.217237 Cc1ccccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000210755 [0,1,0,0,0,1|0,0,0]=2 804 B21R3.217237 Cc1cccnc1SC2C(=O)c3ccccc3C2=O 62a_100000751373_200009813996 [0,1,0,0,0,1|1,0,0]=3 805 B21R3.217237 Cc1cccnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000751373 [0,1,0,0,0,1|1,0,0]=3 806 B21R3.217237 Cc1ccncc1SC2C(=O)c3ccccc3C2=O 62a_100000761580_200009813996 [0,1,0,0,0,1|1,0,0]=3 807 B21R3.217237 Cc1ccncc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000761580 [0,1,0,0,0,1|1,0,0]=3 808 B21R3.217237 Cc1ccnnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000089043 [0,1,0,0,0,1|2,0,0]=4 809 B21R3.217237 Cc1cnccc1SC2C(=O)c3ccccc3C2=O 62a_100000765111_200009813996 [0,1,0,0,0,1|1,0,0]=3 810 B21R3.217237 Cc1cnccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000765111 [0,1,0,0,0,1|1,0,0]=3 811 B21R3.217237 Cc1cncnc1SC2C(=O)c3ccccc3C2=O 62a_100011998708_200009813996 [0,1,0,0,0,1|2,0,0]=4 812 B21R3.217237 Cc1cncnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011998708 [0,1,0,0,0,1|2,0,0]=4 813 B21R3.217237 Cc1ncccc1SC2C(=O)c3ccccc3C2=O 62a_100000751574_200009813996 [0,1,0,0,0,1|1,0,0]=3 814 B21R3.217237 Cc1ncccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000751574 [0,1,0,0,0,1|1,0,0]=3 815 B21R3.217237 Cc1nccnc1SC2C(=O)c3ccccc3C2=O 62a_100011999405_200009813996 [0,1,0,0,0,1|2,0,0]=4 816 B21R3.217237 Cc1nccnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011999405 [0,1,0,0,0,1|2,0,0]=4 817 B21R3.217237 Cc1ncncc1SC2C(=O)c3ccccc3C2=O 62a_100009819671_200009813996 [0,1,0,0,0,1|2,0,0]=4 818 B21R3.217237 Cc1ncncc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100009819671 [0,1,0,0,0,1|2,0,0]=4 819 B21R3.217237 Nc1ccccc1SC2C(=O)c3ccccc3C2=O 62a_100000210017_200009813996 [0,1,0,0,0,1|0,0,0]=2 820 B21R3.217237 Nc1ccccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000210017 [0,1,0,0,0,1|0,0,0]=2 821 B21R3.217237 Nc1cccnc1SC2C(=O)c3ccccc3C2=O 62a_100000688686_200009813996 [0,1,0,0,0,1|1,0,0]=3 822 B21R3.217237 Nc1cccnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000688686 [0,1,0,0,0,1|1,0,0]=3 823 B21R3.217237 Nc1ccncc1SC2C(=O)c3ccccc3C2=O 62a_100000047001_200009813996 [0,1,0,0,0,1|1,0,0]=3 824 B21R3.217237 Nc1ccncc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000047001 [0,1,0,0,0,1|1,0,0]=3 825 B21R3.217237 Nc1cnccc1SC2C(=O)c3ccccc3C2=O 62a_100000756074_200009813996 [0,1,0,0,0,1|1,0,0]=3 826 B21R3.217237 Nc1cnccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000756074 [0,1,0,0,0,1|1,0,0]=3 827 B21R3.217237 Nc1cncnc1SC2C(=O)c3ccccc3C2=O 62a_100000709731_200009813996 [0,1,0,0,0,1|2,0,0]=4 828 B21R3.217237 Nc1cncnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000709731 [0,1,0,0,0,1|2,0,0]=4 829 B21R3.217237 Nc1cnncc1SC2C(=O)c3ccccc3C2=O 62a_100009829405_200009813996 [0,1,0,0,0,1|2,0,0]=4 830 B21R3.217237 Nc1cnncc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100009829405 [0,1,0,0,0,1|2,0,0]=4 831 B21R3.217237 Nc1ncccc1SC2C(=O)c3ccccc3C2=O 62a_100000045569_200009813996 [0,1,0,0,0,1|1,0,0]=3 832 B21R3.217237 Nc1ncccc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000045569 [0,1,0,0,0,1|1,0,0]=3 833 B21R3.217237 Nc1nccnc1SC2C(=O)c3ccccc3C2=O 62a_100000747729_200009813996 [0,1,0,0,0,1|2,0,0]=4 834 B21R3.217237 Nc1nccnc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100000747729 [0,1,0,0,0,1|2,0,0]=4 835 B21R3.217237 Nc1ncncc1SC2C(=O)c3ccccc3C2=O 62a_100011996079_200009813996 [0,1,0,0,0,1|2,0,0]=4 836 B21R3.217237 Nc1ncncc1SC2C(=O)c3ccccc3C2=O 62a_200009813996_100011996079 [0,1,0,0,0,1|2,0,0]=4 837 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3c[nH]ccc3=O 62a_100009998708_200009813996 [0,1,0,0,0,1|1,0,0]=3 838 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3c[nH]ccc3=O 62a_200009813996_100009998708 [0,1,0,0,0,1|1,0,0]=3 839 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3c[nH]ccc3=S 62a_200009813996_200012280681 [0,1,0,0,0,1|1,0,0]=3 840 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3c[nH]ccc3=S 62a_200012280681_200009813996 [0,1,0,0,0,1|1,0,0]=3 841 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccc[n+]3[O-] 62a_200009813996_200000042595 [0,1,0,0,0,1|1,0,0]=3 842 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3Br 62a_100000695589_200009813996 [0,1,0,0,0,1|0,0,0]=2 843 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3Br 62a_200009813996_100000695589 [0,1,0,0,0,1|0,0,0]=2 844 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3Cl 62a_100000764095_200009813996 [0,1,0,0,0,1|0,0,0]=2 845 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3Cl 62a_200009813996_100000764095 [0,1,0,0,0,1|0,0,0]=2 846 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3F 62a_100011215700_200009813996 [0,1,0,0,0,1|0,0,0]=2 847 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3F 62a_200009813996_100011215700 [0,1,0,0,0,1|0,0,0]=2 848 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3O 62a_100000739446_200009813996 [0,1,0,0,0,1|0,0,0]=2 849 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccccc3O 62a_200009813996_100000739446 [0,1,0,0,0,1|0,0,0]=2 850 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3Br 62a_100010202626_200009813996 [0,1,0,0,0,1|1,0,0]=3 851 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3Br 62a_200009813996_100010202626 [0,1,0,0,0,1|1,0,0]=3 852 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3Cl 62a_100000036424_200009813996 [0,1,0,0,0,1|1,0,0]=3 853 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3Cl 62a_200009813996_100000036424 [0,1,0,0,0,1|1,0,0]=3 854 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3F 62a_100009816115_200009813996 [0,1,0,0,0,1|1,0,0]=3 855 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3F 62a_200009813996_100009816115 [0,1,0,0,0,1|1,0,0]=3 856 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3O 62a_100000760158_200009813996 [0,1,0,0,0,1|1,0,0]=3 857 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cccnc3O 62a_200009813996_100000760158 [0,1,0,0,0,1|1,0,0]=3 858 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccn[nH]c3=O 62a_200009813996_100000087129 [0,1,0,0,0,1|2,0,0]=4 859 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3Br 62a_100000726257_200009813996 [0,1,0,0,0,1|1,0,0]=3 860 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3Br 62a_200009813996_100000726257 [0,1,0,0,0,1|1,0,0]=3 861 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3Cl 62a_100000708259_200009813996 [0,1,0,0,0,1|1,0,0]=3 862 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3Cl 62a_200009813996_100000708259 [0,1,0,0,0,1|1,0,0]=3 863 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3F 62a_100000047030_200009813996 [0,1,0,0,0,1|1,0,0]=3 864 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3F 62a_200009813996_100000047030 [0,1,0,0,0,1|1,0,0]=3 865 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3O 62a_100009817591_200009813996 [0,1,0,0,0,1|1,0,0]=3 866 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ccncc3O 62a_200009813996_100009817591 [0,1,0,0,0,1|1,0,0]=3 867 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3Br 62a_100010138639_200009813996 [0,1,0,0,0,1|1,0,0]=3 868 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3Br 62a_200009813996_100010138639 [0,1,0,0,0,1|1,0,0]=3 869 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3Cl 62a_100009995489_200009813996 [0,1,0,0,0,1|1,0,0]=3 870 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3Cl 62a_200009813996_100009995489 [0,1,0,0,0,1|1,0,0]=3 871 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3F 62a_100009820683_200009813996 [0,1,0,0,0,1|1,0,0]=3 872 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cnccc3F 62a_200009813996_100009820683 [0,1,0,0,0,1|1,0,0]=3 873 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3Br 62a_200009813996_200012461658 [0,1,0,0,0,1|2,0,0]=4 874 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3Br 62a_200012461658_200009813996 [0,1,0,0,0,1|2,0,0]=4 875 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3Cl 62a_100000758962_200009813996 [0,1,0,0,0,1|2,0,0]=4 876 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3Cl 62a_200009813996_100000758962 [0,1,0,0,0,1|2,0,0]=4 877 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3O 62a_100000751107_200009813996 [0,1,0,0,0,1|2,0,0]=4 878 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3cncnc3O 62a_200009813996_100000751107 [0,1,0,0,0,1|2,0,0]=4 879 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncc[nH]c3=O 62a_200009813996_100000763361 [0,1,0,0,0,1|2,0,0]=4 880 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3Br 62a_100000696092_200009813996 [0,1,0,0,0,1|1,0,0]=3 881 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3Br 62a_200009813996_100000696092 [0,1,0,0,0,1|1,0,0]=3 882 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3Cl 62a_100011356963_200009813996 [0,1,0,0,0,1|1,0,0]=3 883 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3Cl 62a_200009813996_100011356963 [0,1,0,0,0,1|1,0,0]=3 884 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3F 62a_100000685392_200009813996 [0,1,0,0,0,1|1,0,0]=3 885 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3F 62a_200009813996_100000685392 [0,1,0,0,0,1|1,0,0]=3 886 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3O 62a_100000034122_200009813996 [0,1,0,0,0,1|1,0,0]=3 887 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncccc3O 62a_200009813996_100000034122 [0,1,0,0,0,1|1,0,0]=3 888 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3nccnc3Cl 62a_100010886584_200009813996 [0,1,0,0,0,1|2,0,0]=4 889 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3nccnc3Cl 62a_200009813996_100010886584 [0,1,0,0,0,1|2,0,0]=4 890 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3nccnc3F 62a_200009813996_200010125657 [0,1,0,0,0,1|2,0,0]=4 891 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3nccnc3F 62a_200010125657_200009813996 [0,1,0,0,0,1|2,0,0]=4 892 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncncc3F 62a_100000069762_200009813996 [0,1,0,0,0,1|2,0,0]=4 893 B21R3.217237 O=C1c2ccccc2C(=O)C1Sc3ncncc3F 62a_200009813996_100000069762 [0,1,0,0,0,1|2,0,0]=4 894 B21R3.249334 CN(c1ccccc1)C2C(=O)c3ccccc3C2=O 2230a_100000210012_200009813996 [0,1,0,0,0,1|0,0,0]=2 895 B21R3.249334 CN(c1ccccc1)C2C(=O)c3ccccc3C2=O 269982a_100000210012_200009813996 [0,1,0,0,0,1|0,0,0]=2 896 B21R3.436787 O=C1c2ccc(cc2C(=O)N1Cc3ccccc3)O 271570a_203496583355_100009812378 [0,1,0,0,0,1|1,0,0]=3 897 B21R3.649802 Cc1nc2ccccc2c(=O)n1c3ccc(cc3)O 271570a_203496583355_100000683964 [0,1,0,0,0,1|2,0,0]=4 898 B21R3.3946272 Cc1c(c(=O)n(c2c1cccc2)C)c3ccccc3 271570a_100011218836_100010739255 [0,1,0,0,0,1|1,0,1]=4 899 B21R3.7155661 Cc1c(c(=O)oc2c1ccc(c2)O)c3ccccc3 271570a_100011218836_200009996780 [0,1,0,0,0,1|1,0,1]=4 900 B21R3.787236 C=Cc1ccc2c(c1)C(=O)N(C2=O)c3ccccc3 271570a_100011290941_200103168701 [0,2,0,0,0,0|1,0,0]=3 901 B21R3.787236 CSc1ccc2c(c1)C(=O)N(C2=O)c3ccccc3 62a_200103168701_200000210301 [0,2,0,0,0,0|1,0,0]=3 902 B21R3.787236 [13CH3]Sc1ccc2c(c1)C(=O)N(C2=O)c3ccccc3 62a_200103168701_200025704644 [0,2,0,0,0,0|1,0,0]=3 903 B21R3.181872 C=Cc1ccc(cc1)N2C(=O)c3ccccc3C2=O 271570a_100011290941_100000129684 [0,2,0,0,0,0|1,0,0]=3 904 B21R3.181872 CSc1ccc(cc1)N2C(=O)c3ccccc3C2=O 62a_100000129684_200000210301 [0,2,0,0,0,0|1,0,0]=3 905 B21R3.181872 [13CH3]Sc1ccc(cc1)N2C(=O)c3ccccc3C2=O 62a_100000129684_200025704644 [0,2,0,0,0,0|1,0,0]=3 906 B17R1.3729 C/C=C/C=CC(=O)C(C(=O)C)c1ccccc1 1458a_100000185730_100009888967 [0,0,2,0,0,0|0,0,2]=4 907 B17R1.3729 C/C=C/C=CC(=O)C(C(=O)N)c1ccccc1 1458a_100000185730_100000188848 [0,0,2,0,0,0|1,0,1]=4 908 B17R1.9782 C=CC=CC(=O)C(C(=O)OC)c1ccccc1 1458a_100016291481_100000754950 [0,0,2,0,0,0|1,0,1]=4 909 B19R3.6048 O=c1c(c[nH]c2c1cccc2)c3ccccc3 271570a_100011218836_100012339567 [0,0,1,1,0,0|1,0,1]=4 910 B19R3.6048 O=c1c(coc2c1cccc2)c3ccccc3 271570a_100011218836_100009813851 [0,0,1,1,0,0|0,0,2]=4 911 B19R3.28220 O=Cc1ccccc1C2=Cc3ccccc3C2 271570a_100010239756_100000211189 [0,0,1,1,0,0|1,0,0]=3 912 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3[nH]2 271570a_100000740022_100010232065 [0,0,1,1,0,0|1,0,1]=4 913 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3[nH]2 271570a_100010206980_100000211189 [0,0,1,1,0,0|1,0,1]=4 914 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3o2 271570a_100000740022_100010159458 [0,0,1,1,0,0|0,0,2]=4 915 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3o2 271570a_100011328764_100000211189 [0,0,1,1,0,0|0,0,2]=4 916 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3s2 271570a_100000034353_100000211189 [0,0,1,1,0,0|0,1,1]=4 917 B19R3.28220 O=Cc1ccccc1c2cc3ccccc3s2 271570a_100000740022_100009816949 [0,0,1,1,0,0|0,1,1]=4 918 B19R3.28220 O=Cc1ccccc1c2nc3ccccc3[nH]2 271570a_100000740022_100009814255 [0,0,1,1,0,0|2,0,0]=4 919 B19R3.28220 O=Cc1ccccc1c2nc3ccccc3s2 271570a_100000740022_100000751744 [0,0,1,1,0,0|1,1,0]=4 920 B19R3.28220 O=Cc1ccccc1c2nc3ccccc3s2 271570a_200000082171_100000211189 [0,0,1,1,0,0|1,1,0]=4 921 B19R3.28220 O=Cc1cccnc1C2=Cc3ccccc3C2 271570a_100010239756_100009816751 [0,0,1,1,0,0|2,0,0]=4 922 B19R3.28220 O=Cc1ccncc1C2=Cc3ccccc3C2 271570a_100010239756_100011934409 [0,0,1,1,0,0|2,0,0]=4 923 B19R3.28220 O=Cc1cnccc1C2=Cc3ccccc3C2 271570a_100010239756_100000050567 [0,0,1,1,0,0|2,0,0]=4 924 B19R3.28220 O=Cc1ncccc1C2=Cc3ccccc3C2 271570a_100010239756_100011934733 [0,0,1,1,0,0|2,0,0]=4 925 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccco3 62a_100009814098_200009813996 [0,0,1,1,0,0|2,0,0]=4 926 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccco3 62a_200009813996_100009814098 [0,0,1,1,0,0|2,0,0]=4 927 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3cccs3 62a_100011215356_200009813996 [0,0,1,1,0,0|2,0,0]=4 928 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3cccs3 62a_200009813996_100011215356 [0,0,1,1,0,0|2,0,0]=4 929 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccoc3 62a_100011215275_200009813996 [0,0,1,1,0,0|2,0,0]=4 930 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccoc3 62a_200009813996_100011215275 [0,0,1,1,0,0|2,0,0]=4 931 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccsc3 62a_100000738268_200009813996 [0,0,1,1,0,0|2,0,0]=4 932 B19R3.97997 O=C1c2ccccc2C(=O)C1Sc3ccsc3 62a_200009813996_100000738268 [0,0,1,1,0,0|2,0,0]=4 933 B17R2.1066 C=C(c1ccccc1)c2ccccc2C=O 271570a_100000068269_100000211189 [0,0,1,0,1,0|1,0,0]=3 934 B17R2.1066 C=C(c1ccccc1)c2cccnc2C=O 271570a_100000068269_100011934733 [0,0,1,0,1,0|2,0,0]=4 935 B17R2.1066 C=C(c1ccccc1)c2ccncc2C=O 271570a_100000068269_100000050567 [0,0,1,0,1,0|2,0,0]=4 936 B17R2.1066 C=C(c1ccccc1)c2cnccc2C=O 271570a_100000068269_100011934409 [0,0,1,0,1,0|2,0,0]=4 937 B17R2.1066 C=C(c1ccccc1)c2ncccc2C=O 271570a_100000068269_100009816751 [0,0,1,0,1,0|2,0,0]=4 938 B17R2.1066 C=Cc1ccccc1C(=O)c2ccccc2 271570a_100011290941_100000198044 [0,0,1,0,1,0|1,0,0]=3 939 B17R2.1066 C=Cc1ccccc1C(=O)c2cccnc2 271570a_100011290941_100011532686 [0,0,1,0,1,0|2,0,0]=4 940 B17R2.1066 CNc1ccccc1C(=O)c2ccccc2 27a_100102657272_100000198044 [0,0,1,0,1,0|2,0,0]=4 941 B17R2.1066 COc1ccccc1C(=O)c2ccccc2 7a_100011215220_200000210301 [0,0,1,0,1,0|2,0,0]=4 942 B17R2.1066 CSc1ccccc1C(=O)c2ccccc2 62a_100000198044_200000210301 [0,0,1,0,1,0|2,0,0]=4 943 B17R2.1066 [13CH3]Oc1ccccc1C(=O)c2ccccc2 7a_100011215220_200025704644 [0,0,1,0,1,0|2,0,0]=4 944 B17R2.1066 [13CH3]Sc1ccccc1C(=O)c2ccccc2 62a_100000198044_200025704644 [0,0,1,0,1,0|2,0,0]=4 945 B17R2.2749 C=Cc1ccccc1C(=O)Cc2ccsc2 1458a_100011830265_100011233845 [0,0,1,0,1,0|2,0,0]=4 946 B17R2.2749 O=Ic1ccccc1C(=O)Cc2ccsc2 1458a_100000032414_100011233845 [0,0,1,0,1,0|2,0,0]=4 947 B19R2.201 CCC(NC(=O)c1ccccc1)c2ccccc2 11a_100000737752_100000185807 [0,0,1,0,0,1|1,0,1]=4 948 B19R2.201 CCC(NC(=O)c1ccccc1)c2ccccc2 1626a_100000737752_100000185807 [0,0,1,0,0,1|1,0,1]=4 949 B19R2.201 CCC(NC(=O)c1ccccc1)c2ccccc2 240690a_100000737752_100000185807 [0,0,1,0,0,1|1,0,1]=4 950 B19R2.201 CCC(NC(=O)c1ccccc1)c2ccccc2 527a_100000737752_100000185807 [0,0,1,0,0,1|1,0,1]=4 951 B19R2.201 N#CC(NC(=O)c1ccccc1)c2ccccc2 1626a_100020627052_100000185807 [0,0,1,0,0,1|1,0,1]=4 952 B19R2.201 N#CC(NC(=O)c1ccccc1)c2ccccc2 240690a_100020627052_100000185807 [0,0,1,0,0,1|1,0,1]=4 953 B19R2.201 O=C(N[C@H](CO)c1ccccc1)c2ccccc2 240690a_100000751927_100000185807 [0,0,1,0,0,1|0,0,2]=4 954 B19R2.201 O=C(N[C@H](CO)c1ccccc1)c2ccccc2 527a_100000751927_100000185807 [0,0,1,0,0,1|0,0,2]=4 955 B19R2.2265 CCC(C(=O)Cc1ccccc1)c2ccccc2 1458a_100000211302_100015291786 [0,0,1,0,0,1|1,0,1]=4 956 B19R2.2265 CCC(C(=O)Nc1ccccc1)c2ccccc2 11a_100000106764_100000211302 [0,0,1,0,0,1|1,0,1]=4 957 B19R2.2265 CCC(C(=O)Nc1ccccc1)c2ccccc2 1626a_100000106764_100000211302 [0,0,1,0,0,1|1,0,1]=4 958 B19R2.2265 CCC(C(=O)Nc1ccccc1)c2ccccc2 22a_100000106764_100000211302 [0,0,1,0,0,1|1,0,1]=4 959 B19R2.2265 CCC(C(=O)Nc1ccccc1)c2ccccc2 527a_100000106764_100000211302 [0,0,1,0,0,1|1,0,1]=4 960 B19R2.2265 CNC(C(=O)Nc1ccccc1)c2ccccc2 2230a_106832991635_100015203697 [0,0,1,0,0,1|2,0,0]=4 961 B19R2.2265 CNC(C(=O)Nc1ccccc1)c2ccccc2 7a_106832991635_100015203697 [0,0,1,0,0,1|2,0,0]=4 962 B19R2.2265 CO[C@@H](C(=O)Cc1ccccc1)c2ccccc2 1458a_100000698336_100015291786 [0,0,1,0,0,1|2,0,0]=4 963 B19R2.2265 CO[C@@H](C(=O)Nc1ccccc1)c2ccccc2 11a_100000106764_100000698336 [0,0,1,0,0,1|2,0,0]=4 964 B19R2.2265 CO[C@@H](C(=O)Nc1ccccc1)c2ccccc2 1626a_100000106764_100000698336 [0,0,1,0,0,1|2,0,0]=4 965 B19R2.2265 CO[C@@H](C(=O)Nc1ccccc1)c2ccccc2 22a_100000106764_100000698336 [0,0,1,0,0,1|2,0,0]=4 966 B19R2.2265 CO[C@@H](C(=O)Nc1ccccc1)c2ccccc2 527a_100000106764_100000698336 [0,0,1,0,0,1|2,0,0]=4 967 B19R2.2265 CSC(C(=O)Nc1ccccc1)c2ccccc2 62a_100015203697_200000210301 [0,0,1,0,0,1|2,0,0]=4 968 B19R2.2265 CSC(C(=O)Nc1ccccc1)c2ccccc2 62a_200000210301_100015203697 [0,0,1,0,0,1|2,0,0]=4 969 B19R2.2265 O=C(Cc1ccccc1)C(CO)c2ccccc2 1458a_100011218805_100015291786 [0,0,1,0,0,1|0,0,2]=4 970 B19R2.2265 O=C(Nc1ccccc1)C(CO)c2ccccc2 22a_100000106764_100011218805 [0,0,1,0,0,1|0,0,2]=4 971 B19R2.2265 [13CH3]SC(C(=O)Nc1ccccc1)c2ccccc2 62a_100015203697_200025704644 [0,0,1,0,0,1|2,0,0]=4 972 B19R2.2265 [13CH3]SC(C(=O)Nc1ccccc1)c2ccccc2 62a_200025704644_100015203697 [0,0,1,0,0,1|2,0,0]=4 973 B19R2.9974 N#CC(Cc1ccccc1)C(=O)c2ccccc2 1458a_100000185807_100000183401 [0,0,1,0,0,1|1,0,1]=4 974 B19R2.3385 C=Cc1ccccc1NC(=O)C[n+]2ccccc2 11a_100012022501_200000086051 [0,0,1,0,0,1|2,0,0]=4 975 B19R2.3385 C=Cc1ccccc1NC(=O)C[n+]2ccccc2 22a_100012022501_200000086051 [0,0,1,0,0,1|2,0,0]=4 976 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2ccccn2 11a_100012022501_100000233486 [0,0,1,0,0,1|2,0,0]=4 977 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2ccccn2 22a_100012022501_100000233486 [0,0,1,0,0,1|2,0,0]=4 978 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2cccnc2 11a_100012022501_100000737805 [0,0,1,0,0,1|2,0,0]=4 979 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2cccnc2 22a_100012022501_100000737805 [0,0,1,0,0,1|2,0,0]=4 980 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2ccncc2 11a_100012022501_100011201483 [0,0,1,0,0,1|2,0,0]=4 981 B19R2.3385 C=Cc1ccccc1NC(=O)Cc2ccncc2 22a_100012022501_100011201483 [0,0,1,0,0,1|2,0,0]=4 982 B19R2.3385 CC(Cc1ccccc1)Sc2ccccc2C=O 62a_100000210073_200011218536 [0,0,1,0,0,1|1,0,1]=4 983 B19R2.3385 CC(Cc1ccccc1)Sc2ccccc2C=O 62a_200011218536_100000210073 [0,0,1,0,0,1|1,0,1]=4 984 B19R2.3385 CN(Cc1ccccc1)Cc2ccccc2C=O 2230a_100000186898_200009853537 [0,0,1,0,0,1|2,0,0]=4 985 B19R2.3385 CN(Cc1ccccc1)Cc2ccccc2C=O 269982a_100000186898_200009853537 [0,0,1,0,0,1|2,0,0]=4 986 B19R2.3385 CNc1ccccc1NC(=O)Cc2ccccc2 2230a_100000408246_200000210301 [0,0,1,0,0,1|2,0,0]=4 987 B19R2.3385 COc1ccccc1CC(=O)Cc2ccccc2 1458a_100000211604_100015291786 [0,0,1,0,0,1|2,0,0]=4 988 B19R2.3385 N#Cc1ccccc1CC(=O)Cc2ccccc2 1458a_100000238613_100015291786 [0,0,1,0,0,1|1,0,1]=4 989 B19R2.3385 O=Cc1ccccc1CC(=O)C[n+]2ccccc2 1458a_200000086051_200009853537 [0,0,1,0,0,1|1,0,0]=3 990 B19R2.3385 O=Cc1ccccc1CC(=O)Cc2ccccn2 1458a_100000233486_200009853537 [0,0,1,0,0,1|1,0,0]=3 991 B19R2.3385 O=Cc1ccccc1CC(=O)Cc2cccnc2 1458a_100000737805_200009853537 [0,0,1,0,0,1|1,0,0]=3 992 B19R2.3385 O=Cc1ccccc1CC(=O)Cc2cncnc2 1458a_100000721575_200009853537 [0,0,1,0,0,1|2,0,0]=4 993 B19R2.3385 [13CH3]Nc1ccccc1NC(=O)Cc2ccccc2 2230a_100000408246_200025704644 [0,0,1,0,0,1|2,0,0]=4 994 B19R2.3421 C#Cc1ccccc1C(=O)CCc2ccccc2 1458a_100011243808_100000765856 [0,0,1,0,0,1|1,0,1]=4 995 B19R2.3421 C#Cc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100011243808 [0,0,1,0,0,1|1,0,1]=4 996 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccccc2 1458a_100011830265_100000765856 [0,0,1,0,0,1|1,0,0]=3 997 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccccn2 1458a_100011830265_100015183660 [0,0,1,0,0,1|2,0,0]=4 998 B19R2.3421 C=Cc1ccccc1C(=O)CCc2cccnc2 1458a_100011830265_200011713674 [0,0,1,0,0,1|2,0,0]=4 999 B19R2.3421 C=Cc1ccccc1C(=O)CCc2ccncc2 1458a_100011830265_100000723409 [0,0,1,0,0,1|2,0,0]=4 1000 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100011830265 [0,0,1,0,0,1|1,0,0]=3 1001 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccc2 271570a_100011290941_200000153116 [0,0,1,0,0,1|1,0,0]=3 1002 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccccn2 1626a_100000210449_100011830265 [0,0,1,0,0,1|2,0,0]=4 1003 B19R2.3421 C=Cc1ccccc1C(=O)NCc2ccncc2 1626a_100000210450_100011830265 [0,0,1,0,0,1|2,0,0]=4 1004 B19R2.3421 C=Cc1ccccc1C(=O)NNc2ccccc2 22a_100015195140_100011830265 [0,0,1,0,0,1|2,0,0]=4 1005 B19R2.3421 C=Cc1ncccc1C(=O)NCc2ccccc2 271570a_100011290941_200000153156 [0,0,1,0,0,1|2,0,0]=4 1006 B19R2.3421 CCc1ccccc1C(=O)CCc2ccccc2 1458a_100000689120_100000765856 [0,0,1,0,0,1|1,0,1]=4 1007 B19R2.3421 CCc1ccccc1C(=O)NCc2ccccc2 11a_100015324214_100000689120 [0,0,1,0,0,1|1,0,1]=4 1008 B19R2.3421 CCc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000689120 [0,0,1,0,0,1|1,0,1]=4 1009 B19R2.3421 CCc1ccccc1C(=O)NCc2ccccc2 240690a_100015324214_100000689120 [0,0,1,0,0,1|1,0,1]=4 1010 B19R2.3421 CCc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000689120 [0,0,1,0,0,1|1,0,1]=4 1011 B19R2.3421 CNc1ccccc1C(=O)NCc2ccccc2 2230a_100000594210_200000210301 [0,0,1,0,0,1|2,0,0]=4 1012 B19R2.3421 CNc1ccccc1C(=O)NCc2ccccc2 27a_100102657272_200000153116 [0,0,1,0,0,1|2,0,0]=4 1013 B19R2.3421 CNc1ccccc1C(=O)NCc2ccccc2 34a_100000594210_200000210301 [0,0,1,0,0,1|2,0,0]=4 1014 B19R2.3421 COc1ccccc1C(=O)CCc2ccccc2 1458a_100000185835_100000765856 [0,0,1,0,0,1|2,0,0]=4 1015 B19R2.3421 COc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_200000210301 [0,0,1,0,0,1|2,0,0]=4 1016 B19R2.3421 COc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_200000210301 [0,0,1,0,0,1|2,0,0]=4 1017 B19R2.3421 COc1ccccc1C(=O)CNc2ccccc2 34a_100000106764_100000195505 [0,0,1,0,0,1|2,0,0]=4 1018 B19R2.3421 COc1ccccc1C(=O)COc2ccccc2 34a_100000210340_100000195505 [0,0,1,0,0,1|2,0,0]=4 1019 B19R2.3421 COc1ccccc1C(=O)COc2ccccc2 7a_100000210340_100000195505 [0,0,1,0,0,1|2,0,0]=4 1020 B19R2.3421 COc1ccccc1C(=O)CSc2ccccc2 62a_100000195505_100000041952 [0,0,1,0,0,1|2,0,0]=4 1021 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 11a_100015324214_100000185835 [0,0,1,0,0,1|2,0,0]=4 1022 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000185835 [0,0,1,0,0,1|2,0,0]=4 1023 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 240690a_100015324214_100000185835 [0,0,1,0,0,1|2,0,0]=4 1024 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 34a_100000153128_200000210301 [0,0,1,0,0,1|2,0,0]=4 1025 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000185835 [0,0,1,0,0,1|2,0,0]=4 1026 B19R2.3421 COc1ccccc1C(=O)NCc2ccccc2 7a_100000153128_200000210301 [0,0,1,0,0,1|2,0,0]=4 1027 B19R2.3421 COc1ccccc1C(=O)OCc2ccccc2 7a_100000000771_200000210301 [0,0,1,0,0,1|2,0,0]=4 1028 B19R2.3421 CSc1ccccc1C(=O)CCc2ccccc2 1458a_100000183967_100000765856 [0,0,1,0,0,1|2,0,0]=4 1029 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 11a_100015324214_100000183967 [0,0,1,0,0,1|2,0,0]=4 1030 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000183967 [0,0,1,0,0,1|2,0,0]=4 1031 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 240690a_100015324214_100000183967 [0,0,1,0,0,1|2,0,0]=4 1032 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000183967 [0,0,1,0,0,1|2,0,0]=4 1033 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 62a_200000153116_200000210301 [0,0,1,0,0,1|2,0,0]=4 1034 B19R2.3421 CSc1ccccc1C(=O)NCc2ccccc2 62a_200000210301_200000153116 [0,0,1,0,0,1|2,0,0]=4 1035 B19R2.3421 N#Cc1ccccc1C(=O)CCc2ccccc2 1458a_100000742908_100000765856 [0,0,1,0,0,1|1,0,1]=4 1036 B19R2.3421 N#Cc1ccccc1C(=O)NCc2ccccc2 11a_100015324214_100000742908 [0,0,1,0,0,1|1,0,1]=4 1037 B19R2.3421 N#Cc1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000742908 [0,0,1,0,0,1|1,0,1]=4 1038 B19R2.3421 N#Cc1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000742908 [0,0,1,0,0,1|1,0,1]=4 1039 B19R2.3421 O=C(CCc1ccccc1)c2ccccc2CO 1458a_100011301526_100000765856 [0,0,1,0,0,1|0,0,2]=4 1040 B19R2.3421 O=Ic1ccccc1C(=O)CCc2ccccc2 1458a_100000032414_100000765856 [0,0,1,0,0,1|1,0,0]=3 1041 B19R2.3421 O=Ic1ccccc1C(=O)CCc2ccccn2 1458a_100000032414_100015183660 [0,0,1,0,0,1|2,0,0]=4 1042 B19R2.3421 O=Ic1ccccc1C(=O)CCc2cccnc2 1458a_100000032414_200011713674 [0,0,1,0,0,1|2,0,0]=4 1043 B19R2.3421 O=Ic1ccccc1C(=O)CCc2ccncc2 1458a_100000032414_100000723409 [0,0,1,0,0,1|2,0,0]=4 1044 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccc2 1626a_100015324214_100000032414 [0,0,1,0,0,1|1,0,0]=3 1045 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccc2 240690a_100015324214_100000032414 [0,0,1,0,0,1|1,0,0]=3 1046 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccc2 527a_100015324214_100000032414 [0,0,1,0,0,1|1,0,0]=3 1047 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccn2 1626a_100000210449_100000032414 [0,0,1,0,0,1|2,0,0]=4 1048 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccn2 240690a_100000210449_100000032414 [0,0,1,0,0,1|2,0,0]=4 1049 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccccn2 527a_100000210449_100000032414 [0,0,1,0,0,1|2,0,0]=4 1050 B19R2.3421 O=Ic1ccccc1C(=O)NCc2cccnc2 240690a_100000210453_100000032414 [0,0,1,0,0,1|2,0,0]=4 1051 B19R2.3421 O=Ic1ccccc1C(=O)NCc2cccnc2 527a_100000210453_100000032414 [0,0,1,0,0,1|2,0,0]=4 1052 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccncc2 1626a_100000210450_100000032414 [0,0,1,0,0,1|2,0,0]=4 1053 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccncc2 240690a_100000210450_100000032414 [0,0,1,0,0,1|2,0,0]=4 1054 B19R2.3421 O=Ic1ccccc1C(=O)NCc2ccncc2 527a_100000210450_100000032414 [0,0,1,0,0,1|2,0,0]=4 1055 B19R2.3421 O=Ic1ccccc1C(=O)NNc2ccccc2 22a_100015195140_100000032414 [0,0,1,0,0,1|2,0,0]=4 1056 B19R2.3421 [13CH3]Nc1ccccc1C(=O)NCc2ccccc2 2230a_100000594210_200025704644 [0,0,1,0,0,1|2,0,0]=4 1057 B19R2.3421 [13CH3]Nc1ccccc1C(=O)NCc2ccccc2 34a_100000594210_200025704644 [0,0,1,0,0,1|2,0,0]=4 1058 B19R2.3421 [13CH3]Oc1ccccc1C(=O)CCc2ccccc2 34a_100000620706_200025704644 [0,0,1,0,0,1|2,0,0]=4 1059 B19R2.3421 [13CH3]Oc1ccccc1C(=O)CCc2ccccc2 7a_100000620706_200025704644 [0,0,1,0,0,1|2,0,0]=4 1060 B19R2.3421 [13CH3]Oc1ccccc1C(=O)NCc2ccccc2 34a_100000153128_200025704644 [0,0,1,0,0,1|2,0,0]=4 1061 B19R2.3421 [13CH3]Oc1ccccc1C(=O)NCc2ccccc2 7a_100000153128_200025704644 [0,0,1,0,0,1|2,0,0]=4 1062 B19R2.3421 [13CH3]Oc1ccccc1C(=O)OCc2ccccc2 7a_100000000771_200025704644 [0,0,1,0,0,1|2,0,0]=4 1063 B19R2.3421 [13CH3]Sc1ccccc1C(=O)NCc2ccccc2 62a_200000153116_200025704644 [0,0,1,0,0,1|2,0,0]=4 1064 B19R2.3421 [13CH3]Sc1ccccc1C(=O)NCc2ccccc2 62a_200025704644_200000153116 [0,0,1,0,0,1|2,0,0]=4 1065 B19R3.182 O=C1c2ccccc2CC1Sc3ccccc3 62a_100000719477_100011218503 [1,0,0,0,0,1|0,0,1]=3 1066 B19R3.182 O=C1c2ccccc2CC1Sc3ccccc3 62a_100011218503_100000041952 [1,0,0,0,0,1|0,0,1]=3 1067 B19R3.182 O=C1c2ccccc2CC1Sc3ccccn3 62a_100011216584_100011218503 [1,0,0,0,0,1|1,0,1]=4 1068 B19R3.182 O=C1c2ccccc2CC1Sc3ccccn3 62a_100011218503_100011216584 [1,0,0,0,0,1|1,0,1]=4 1069 B19R3.182 O=C1c2ccccc2CC1Sc3cccnc3 62a_100000210063_100011218503 [1,0,0,0,0,1|1,0,1]=4 1070 B19R3.182 O=C1c2ccccc2CC1Sc3cccnc3 62a_100011218503_100000210063 [1,0,0,0,0,1|1,0,1]=4 1071 B19R3.182 O=C1c2ccccc2CC1Sc3ccncc3 62a_100000728582_100011218503 [1,0,0,0,0,1|1,0,1]=4 1072 B19R3.182 O=C1c2ccccc2CC1Sc3ccncc3 62a_100011218503_100000728582 [1,0,0,0,0,1|1,0,1]=4 1073 B19R3.291 Clc1nc2ccccc2cc1c3ccccc3 271570a_100011218836_100010220712 [1,0,0,0,0,1|1,0,1]=4 1074 B19R3.291 Clc1nc2ccccc2cc1c3ccccc3 271570a_200000043004_100000210277 [1,0,0,0,0,1|1,0,1]=4 1075 B19R3.291 Fc1nc2ccccc2cc1c3ccccc3 271570a_100011218836_100011158909 [1,0,0,0,0,1|1,0,1]=4 1076 B19R3.291 Fc1nc2ccccc2cc1c3ccccc3 271570a_200000042388_100000210277 [1,0,0,0,0,1|1,0,1]=4 1077 B19R3.291 Nc1cc2ccccc2cc1c3ccccc3 271570a_100011218836_100009991566 [1,0,0,0,0,1|1,0,1]=4 1078 B19R3.291 Nc1nc2ccccc2cc1c3ccccc3 271570a_100011218836_100010135404 [1,0,0,0,0,1|1,0,1]=4 1079 B19R3.291 O=c1oc2ccccc2cc1c3ccccc3 271570a_100011218836_200000187772 [1,0,0,0,0,1|0,0,1]=3 1080 B19R3.291 O=c1oc2ccccc2cc1c3ccccn3 271570a_100011264011_200000187772 [1,0,0,0,0,1|1,0,1]=4 1081 B19R3.291 O=c1oc2ccccc2cc1c3cccnc3 271570a_100000757648_200000187772 [1,0,0,0,0,1|1,0,1]=4 1082 B19R3.291 O=c1oc2ccccc2cc1c3ccncc3 271570a_100000752145_200000187772 [1,0,0,0,0,1|1,0,1]=4 1083 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_100009888625_100000210277 [1,0,0,0,0,1|0,0,2]=4 1084 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_100011218836_100009817189 [1,0,0,0,0,1|0,0,2]=4 1085 B19R3.291 Oc1cc2ccccc2cc1c3ccccc3 271570a_203496583355_200102591465 [1,0,0,0,0,1|0,0,2]=4 1086 B19R3.291 Oc1nc2ccccc2cc1c3ccccc3 271570a_100011218836_200009820883 [1,0,0,0,0,1|0,0,2]=4 1087 B19R3.291 Oc1nc2ccccc2cc1c3ccccc3 271570a_203496583355_100015267906 [1,0,0,0,0,1|0,0,2]=4 1088 B19R3.9171 Nc1cc(cc2c1cccc2)c3ccccc3 271570a_100011218836_100010171453 [1,0,0,0,0,1|1,0,1]=4 1089 B19R3.9171 Nc1nc(cc2c1cccc2)c3ccccc3 271570a_100011218836_100009957331 [1,0,0,0,0,1|1,0,1]=4 1090 B19R3.9171 O=c1cc([nH]c2c1cccc2)c3ccccc3 271570a_100011218836_100000090176 [1,0,0,0,0,1|1,0,1]=4 1091 B19R3.9171 Oc1cc(cc2c1cccc2)c3ccccc3 271570a_100011218836_100010089979 [1,0,0,0,0,1|0,0,2]=4 1092 B19R3.9171 Oc1cc(cc2c1cccc2)c3ccccc3 271570a_203496583355_100134618259 [1,0,0,0,0,1|0,0,2]=4 1093 B21R3.13199 O=C1c2ccccc2C(=O)C1NCc3ccccc3 2230a_100015324214_200009813996 [0,0,0,0,0,2|0,0,0]=2 1094 B21R3.13199 O=C1c2ccccc2C(=O)C1NCc3cccnn3 2230a_100159270163_200009813996 [0,0,0,0,0,2|2,0,0]=4 1095 B21R3.13199 O=C1c2ccccc2C(=O)C1NCc3cncnc3 2230a_100011243677_200009813996 [0,0,0,0,0,2|2,0,0]=4 1096 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccccc3 62a_100000211182_200009813996 [0,0,0,0,0,2|0,0,0]=2 1097 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccccc3 62a_200009813996_100015291786 [0,0,0,0,0,2|0,0,0]=2 1098 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccccn3 62a_100000721315_200009813996 [0,0,0,0,0,2|1,0,0]=3 1099 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccccn3 62a_200009813996_100000721315 [0,0,0,0,0,2|1,0,0]=3 1100 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cccnc3 62a_100000741622_200009813996 [0,0,0,0,0,2|1,0,0]=3 1101 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cccnc3 62a_200009813996_100000741622 [0,0,0,0,0,2|1,0,0]=3 1102 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cccnn3 62a_100016990269_200009813996 [0,0,0,0,0,2|2,0,0]=4 1103 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cccnn3 62a_200009813996_100016990269 [0,0,0,0,0,2|2,0,0]=4 1104 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccncc3 62a_100015193705_200009813996 [0,0,0,0,0,2|1,0,0]=3 1105 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ccncc3 62a_200009813996_100015193705 [0,0,0,0,0,2|1,0,0]=3 1106 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cnccn3 62a_100016995436_200009813996 [0,0,0,0,0,2|2,0,0]=4 1107 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cnccn3 62a_200009813996_100016995436 [0,0,0,0,0,2|2,0,0]=4 1108 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cncnc3 62a_100015196519_200009813996 [0,0,0,0,0,2|2,0,0]=4 1109 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3cncnc3 62a_200009813996_100015196519 [0,0,0,0,0,2|2,0,0]=4 1110 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ncccn3 62a_100000703007_200009813996 [0,0,0,0,0,2|2,0,0]=4 1111 B21R3.13199 O=C1c2ccccc2C(=O)C1SCc3ncccn3 62a_200009813996_100000703007 [0,0,0,0,0,2|2,0,0]=4 1112 B21R3.13199 O=C1c2ccccc2C(=O)N1COc3ccccc3 7a_100000210340_100000211781 [0,0,0,0,0,2|1,0,0]=3 1113 B21R3.13199 O=C1c2ccccc2C(=O)N1COc3cccnc3 7a_100000210849_100000211781 [0,0,0,0,0,2|2,0,0]=4 1114 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccccc3 62a_100000211781_100000041952 [0,0,0,0,0,2|1,0,0]=3 1115 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccccc3 62a_100000719477_100000211781 [0,0,0,0,0,2|1,0,0]=3 1116 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccccn3 62a_100000211781_100011216584 [0,0,0,0,0,2|2,0,0]=4 1117 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccccn3 62a_100011216584_100000211781 [0,0,0,0,0,2|2,0,0]=4 1118 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3cccnc3 62a_100000210063_100000211781 [0,0,0,0,0,2|2,0,0]=4 1119 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3cccnc3 62a_100000211781_100000210063 [0,0,0,0,0,2|2,0,0]=4 1120 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccncc3 62a_100000211781_100000728582 [0,0,0,0,0,2|2,0,0]=4 1121 B21R3.13199 O=C1c2ccccc2C(=O)N1CSc3ccncc3 62a_100000728582_100000211781 [0,0,0,0,0,2|2,0,0]=4 1122 B21R3.19605 O=c1oc2ccccc2c(c1Sc3ccccc3)O 62a_100000719477_100009994742 [0,0,0,0,0,2|0,0,2]=4