0 B21R2.24297 C#CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100010269958 [0,0,0,0,0,0|3,0,1]=4 1 B21R2.24297 C#CCCCCSc1ccccc1Cc2ccccc2 62a_100010269958_200011216382 [0,0,0,0,0,0|1,1,1]=3 2 B21R2.24297 C#CCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100010269958 [0,0,0,0,0,0|1,1,1]=3 3 B21R2.24297 C#CCCCCSc1ccccc1Nc2ccccc2 62a_100010269958_100009815782 [0,0,0,0,0,0|2,1,1]=4 4 B21R2.24297 C#CCCCCSc1ccccc1Oc2ccccc2 62a_100010269958_100000049502 [0,0,0,0,0,0|2,1,1]=4 5 B21R2.24297 C=CCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011215482 [0,0,0,0,0,0|2,0,1]=3 6 B21R2.24297 C=CCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011215482 [0,0,0,0,0,0|2,0,1]=3 7 B21R2.24297 C=CCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215482 [0,0,0,0,0,0|2,0,1]=3 8 B21R2.24297 C=CCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011215482 [0,0,0,0,0,0|3,0,1]=4 9 B21R2.24297 C=CCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011215482 [0,0,0,0,0,0|3,0,1]=4 10 B21R2.24297 C=CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011215482 [0,0,0,0,0,0|3,0,1]=4 11 B21R2.24297 C=CCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011215482 [0,0,0,0,0,0|1,0,1]=2 12 B21R2.24297 C=CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215482 [0,0,0,0,0,0|1,0,1]=2 13 B21R2.24297 C=CCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011215482 [0,0,0,0,0,0|2,0,1]=3 14 B21R2.24297 C=CCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011215482 [0,0,0,0,0,0|2,0,1]=3 15 B21R2.24297 C=CCCCCSc1ccccc1Cc2ccccc2 62a_100011215482_200011216382 [0,0,0,0,0,0|1,1,1]=3 16 B21R2.24297 C=CCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011215482 [0,0,0,0,0,0|1,1,1]=3 17 B21R2.24297 C=CCCCCSc1ccccc1Nc2ccccc2 62a_100011215482_100009815782 [0,0,0,0,0,0|2,1,1]=4 18 B21R2.24297 C=CCCCCSc1ccccc1Oc2ccccc2 62a_100011215482_100000049502 [0,0,0,0,0,0|2,1,1]=4 19 B21R2.24297 C=CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000757094 [0,0,0,0,0,0|3,0,1]=4 20 B21R2.24297 C=CCCCSCc1ccccc1Cc2ccccc2 62a_100011713584_100010254464 [0,0,0,0,0,0|3,0,1]=4 21 B21R2.24297 CC/C=C\CCNc1ccccc1Cc2ccccc2 2230a_100000211252_100015370543 [0,0,0,0,0,0|2,0,2]=4 22 B21R2.24297 CC/C=C\CCNc1ccccc1Cc2ccccc2 34a_100000211252_100015370543 [0,0,0,0,0,0|2,0,2]=4 23 B21R2.24297 CC/C=C\CCNc1ccccc1Cc2ccccc2 7a_100000211252_100015370543 [0,0,0,0,0,0|2,0,2]=4 24 B21R2.24297 CC/C=C\CCOc1ccccc1Cc2ccccc2 34a_100000211249_100015370543 [0,0,0,0,0,0|1,0,2]=3 25 B21R2.24297 CC/C=C\CCOc1ccccc1Cc2ccccc2 7a_100000211249_100015370543 [0,0,0,0,0,0|1,0,2]=3 26 B21R2.24297 CC/C=C\CCOc1ccccc1Oc2ccccc2 34a_100000074787_100015370543 [0,0,0,0,0,0|2,0,2]=4 27 B21R2.24297 CC/C=C\CCOc1ccccc1Oc2ccccc2 7a_100000074787_100015370543 [0,0,0,0,0,0|2,0,2]=4 28 B21R2.24297 CC/C=C\CCSc1ccccc1Cc2ccccc2 62a_100015370543_200011216382 [0,0,0,0,0,0|1,1,2]=4 29 B21R2.24297 CC/C=C\CCSc1ccccc1Cc2ccccc2 62a_200011216382_100015370543 [0,0,0,0,0,0|1,1,2]=4 30 B21R2.24297 CCCCCC=Cc1ccccc1Cc2ccccc2 271570a_100000062253_200011216382 [0,0,0,0,0,0|2,0,1]=3 31 B21R2.24297 CCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000210314 [0,0,0,0,0,0|2,0,0]=2 32 B21R2.24297 CCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000210314 [0,0,0,0,0,0|2,0,0]=2 33 B21R2.24297 CCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000210314 [0,0,0,0,0,0|2,0,0]=2 34 B21R2.24297 CCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000210314 [0,0,0,0,0,0|3,0,0]=3 35 B21R2.24297 CCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000210314 [0,0,0,0,0,0|3,0,0]=3 36 B21R2.24297 CCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000210314 [0,0,0,0,0,0|3,0,0]=3 37 B21R2.24297 CCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000210314 [0,0,0,0,0,0|1,0,0]=1 38 B21R2.24297 CCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000210314 [0,0,0,0,0,0|1,0,0]=1 39 B21R2.24297 CCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000210314 [0,0,0,0,0,0|2,0,0]=2 40 B21R2.24297 CCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000210314 [0,0,0,0,0,0|2,0,0]=2 41 B21R2.24297 CCCCCCSc1ccccc1Cc2ccccc2 62a_100000210314_200011216382 [0,0,0,0,0,0|1,1,0]=2 42 B21R2.24297 CCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000210757 [0,0,0,0,0,0|1,1,0]=2 43 B21R2.24297 CCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000718602 [0,0,0,0,0,0|4,0,0]=4 44 B21R2.24297 CCCCCOCc1ccccc1Oc2ccccc2 7a_100000210253_100000199117 [0,0,0,0,0,0|4,0,0]=4 45 B21R2.24297 CCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000210326 [0,0,0,0,0,0|4,0,0]=4 46 B21R2.24297 CCCCCSCc1ccccc1Cc2ccccc2 62a_100000210326_100010254464 [0,0,0,0,0,0|3,0,0]=3 47 B21R2.24297 CCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000210326 [0,0,0,0,0,0|3,0,0]=3 48 B21R2.24297 CCCCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000210326 [0,0,0,0,0,0|4,0,0]=4 49 B21R2.24297 CCCCCSCc1ccccc1Oc2ccccc2 62a_100000210326_100000199117 [0,0,0,0,0,0|4,0,0]=4 50 B21R2.24297 CCCCOCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011995733 [0,0,0,0,0,0|4,0,0]=4 51 B21R2.24297 CCCCOCSc1ccccc1Cc2ccccc2 62a_100011995733_200011216382 [0,0,0,0,0,0|2,1,0]=3 52 B21R2.24297 CCCCOCSc1ccccc1Cc2ccccc2 62a_200011216382_100011995733 [0,0,0,0,0,0|2,1,0]=3 53 B21R2.24297 CCCCOCSc1ccccc1Nc2ccccc2 62a_100011995733_100009815782 [0,0,0,0,0,0|3,1,0]=4 54 B21R2.24297 CCCCOCSc1ccccc1Oc2ccccc2 62a_100011995733_100000049502 [0,0,0,0,0,0|3,1,0]=4 55 B21R2.24297 CCCOCCSc1ccccc1Oc2ccccc2 62a_100011215938_100000049502 [0,0,0,0,0,0|3,1,0]=4 56 B21R2.24297 CCOCCCSc1ccccc1Oc2ccccc2 62a_100012232248_100000049502 [0,0,0,0,0,0|3,1,0]=4 57 B21R2.24297 CCSCCSCc1ccccc1Cc2ccccc2 62a_100000757381_100010254464 [0,0,0,0,0,0|4,0,0]=4 58 B21R2.24297 CCSCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000757381 [0,0,0,0,0,0|4,0,0]=4 59 B21R2.24297 COCCCCSc1ccccc1Oc2ccccc2 62a_100000730899_100000049502 [0,0,0,0,0,0|2,1,0]=3 60 B21R2.24297 FCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000729378 [0,0,0,0,0,0|4,0,0]=4 61 B21R2.24297 FCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000729378 [0,0,0,0,0,0|4,0,0]=4 62 B21R2.24297 FCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000729378 [0,0,0,0,0,0|4,0,0]=4 63 B21R2.24297 FCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000729378 [0,0,0,0,0,0|3,0,0]=3 64 B21R2.24297 FCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000729378 [0,0,0,0,0,0|3,0,0]=3 65 B21R2.24297 FCCCCCSc1ccccc1Cc2ccccc2 62a_100000729378_200011216382 [0,0,0,0,0,0|2,1,0]=3 66 B21R2.24297 FCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000729378 [0,0,0,0,0,0|2,1,0]=3 67 B21R2.24297 FCCCCCSc1ccccc1Nc2ccccc2 62a_100000729378_100009815782 [0,0,0,0,0,0|3,1,0]=4 68 B21R2.24297 FCCCCCSc1ccccc1Oc2ccccc2 62a_100000729378_100000049502 [0,0,0,0,0,0|3,1,0]=4 69 B21R2.24297 FCCCCSCc1ccccc1Cc2ccccc2 62a_100000729493_100010254464 [0,0,0,0,0,0|4,0,0]=4 70 B21R2.24297 FCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000729493 [0,0,0,0,0,0|4,0,0]=4 71 B21R2.24297 ICCCCOCc1ccccc1Cc2ccccc2 34a_200012148704_100010254464 [0,0,0,0,0,0|4,0,0]=4 72 B21R2.24297 N#CCCCCSc1ccccc1Cc2ccccc2 62a_100011219923_200011216382 [0,0,0,0,0,0|2,1,0]=3 73 B21R2.24297 N#CCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000211819 [0,0,0,0,0,0|2,1,0]=3 74 B21R2.24297 N#CCCCCSc1ccccc1Nc2ccccc2 62a_100011219923_100009815782 [0,0,0,0,0,0|3,1,0]=4 75 B21R2.24297 N#CCCCCSc1ccccc1Oc2ccccc2 62a_100011219923_100000049502 [0,0,0,0,0,0|3,1,0]=4 76 B20R2.16905 C/C=C/CSCc1ccccc1Cc2ccccc2 62a_100010254464_100102629194 [1,0,0,0,0,0|2,0,1]=4 77 B20R2.16905 C/C=C/CSCc1ccccc1Cc2ccccc2 62a_100102629194_100010254464 [1,0,0,0,0,0|2,0,1]=4 78 B20R2.16905 C=CCCCSc1ccccc1Cc2ccccc2 62a_100011713584_200011216382 [1,0,0,0,0,0|0,1,2]=4 79 B20R2.16905 C=CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000757094 [1,0,0,0,0,0|0,1,2]=4 80 B20R2.16905 C=CCCSCc1ccccc1Cc2ccccc2 62a_100000754431_100010254464 [1,0,0,0,0,0|2,0,1]=4 81 B20R2.16905 C=CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000754431 [1,0,0,0,0,0|2,0,1]=4 82 B20R2.16905 CC/C=C\CSc1ccccc1Cc2ccccc2 62a_100103147603_200011216382 [1,0,0,0,0,0|0,1,2]=4 83 B20R2.16905 CC/C=C\CSc1ccccc1Cc2ccccc2 62a_200011216382_100103147603 [1,0,0,0,0,0|0,1,2]=4 84 B20R2.16905 CC=CCSCc1ccccc1Cc2ccccc2 62a_100000070051_100010254464 [1,0,0,0,0,0|2,0,1]=4 85 B20R2.16905 CC=CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000070051 [1,0,0,0,0,0|2,0,1]=4 86 B20R2.16905 CCCCC=Cc1ccccc1Cc2ccccc2 271570a_100016275911_200011216382 [1,0,0,0,0,0|1,0,1]=3 87 B20R2.16905 CCCCC=Cc1ccccc1Oc2ccccc2 271570a_100016275911_100000049502 [1,0,0,0,0,0|2,0,1]=4 88 B20R2.16905 CCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000210326 [1,0,0,0,0,0|2,0,0]=3 89 B20R2.16905 CCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000718602 [1,0,0,0,0,0|2,0,0]=3 90 B20R2.16905 CCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000210326 [1,0,0,0,0,0|2,0,0]=3 91 B20R2.16905 CCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000718602 [1,0,0,0,0,0|1,0,0]=2 92 B20R2.16905 CCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000210326 [1,0,0,0,0,0|1,0,0]=2 93 B20R2.16905 CCCCCSc1ccccc1Cc2ccccc2 62a_100000210326_200011216382 [1,0,0,0,0,0|0,1,0]=2 94 B20R2.16905 CCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000210326 [1,0,0,0,0,0|0,1,0]=2 95 B20R2.16905 CCCCCSc1ccccc1Nc2ccccc2 62a_100000210326_100009815782 [1,0,0,0,0,0|1,1,0]=3 96 B20R2.16905 CCCCCSc1ccccc1Oc2ccccc2 62a_100000210326_100000049502 [1,0,0,0,0,0|1,1,0]=3 97 B20R2.16905 CCCCSCc1ccccc1Cc2ccccc2 62a_100000210211_100010254464 [1,0,0,0,0,0|2,0,0]=3 98 B20R2.16905 CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000210210 [1,0,0,0,0,0|2,0,0]=3 99 B20R2.16905 CCCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000210210 [1,0,0,0,0,0|3,0,0]=4 100 B20R2.16905 CCCCSCc1ccccc1Oc2ccccc2 62a_100000210211_100000199117 [1,0,0,0,0,0|3,0,0]=4 101 B20R2.16905 CCCCSCc1ccccc1Sc2ccccc2 62a_100000719477_200011870348 [1,0,0,0,0,0|3,0,0]=4 102 B20R2.16905 CCCCSCc1ccccc1Sc2ccccc2 62a_200011870348_100000041952 [1,0,0,0,0,0|3,0,0]=4 103 B20R2.16905 CCSCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000757381 [1,0,0,0,0,0|3,0,0]=4 104 B20R2.16905 CCSCCSc1ccccc1Cc2ccccc2 62a_100000757381_200011216382 [1,0,0,0,0,0|1,1,0]=3 105 B20R2.16905 CCSCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000757381 [1,0,0,0,0,0|1,1,0]=3 106 B20R2.16905 CCSCCSc1ccccc1Nc2ccccc2 62a_100000757381_100009815782 [1,0,0,0,0,0|2,1,0]=4 107 B20R2.16905 CCSCCSc1ccccc1Oc2ccccc2 62a_100000757381_100000049502 [1,0,0,0,0,0|2,1,0]=4 108 B20R2.16905 CSCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000751147 [1,0,0,0,0,0|3,0,0]=4 109 B20R2.16905 CSCCSCc1ccccc1Oc2ccccc2 62a_100000212216_100000199117 [1,0,0,0,0,0|3,0,0]=4 110 B20R2.16905 FCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000729493 [1,0,0,0,0,0|3,0,0]=4 111 B20R2.16905 FCCCCSc1ccccc1Cc2ccccc2 62a_100000729493_200011216382 [1,0,0,0,0,0|1,1,0]=3 112 B20R2.16905 FCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000729493 [1,0,0,0,0,0|1,1,0]=3 113 B20R2.16905 FCCCCSc1ccccc1Nc2ccccc2 62a_100000729493_100009815782 [1,0,0,0,0,0|2,1,0]=4 114 B20R2.16905 FCCCCSc1ccccc1Oc2ccccc2 62a_100000729493_100000049502 [1,0,0,0,0,0|2,1,0]=4 115 B22R2.2102 CCCCCC(C)Nc1ccccc1Cc2ccccc2 2230a_100000211252_200011218191 [0,1,0,0,0,0|2,0,0]=3 116 B22R2.2102 CCCCCC(C)Nc1ccccc1Cc2ccccc2 34a_100000211252_200011218191 [0,1,0,0,0,0|2,0,0]=3 117 B22R2.2102 CCCCCC(C)Nc1ccccc1Cc2ccccc2 7a_100000211252_200011218191 [0,1,0,0,0,0|2,0,0]=3 118 B22R2.2102 CCCCCC(C)Nc1ccccc1Oc2ccccc2 2230a_100000182328_200011218191 [0,1,0,0,0,0|3,0,0]=4 119 B22R2.2102 CCCCCC(C)Nc1ccccc1Oc2ccccc2 34a_100000182328_200011218191 [0,1,0,0,0,0|3,0,0]=4 120 B22R2.2102 CCCCCC(C)Oc1ccccc1Cc2ccccc2 34a_100000211249_200011218191 [0,1,0,0,0,0|1,0,0]=2 121 B22R2.2102 CCCCCC(C)Oc1ccccc1Cc2ccccc2 7a_100000211249_200011218191 [0,1,0,0,0,0|1,0,0]=2 122 B22R2.2102 CCCCCC(C)Oc1ccccc1Oc2ccccc2 34a_100000074787_200011218191 [0,1,0,0,0,0|2,0,0]=3 123 B22R2.2102 CCCCCC(C)Oc1ccccc1Oc2ccccc2 7a_100000074787_200011218191 [0,1,0,0,0,0|2,0,0]=3 124 B22R2.2102 CCCCCC(C)Oc1ccccc1Oc2ccccn2 34a_100000748224_200011218191 [0,1,0,0,0,0|3,0,0]=4 125 B22R2.8322 BrCCCCCOCc1ccccc1Cc2ccccc2 34a_100000746331_100010254464 [0,1,0,0,0,0|2,0,0]=3 126 B22R2.8322 BrCCCCCOCc1ccccc1Cc2ccccc2 7a_100000746331_100010254464 [0,1,0,0,0,0|2,0,0]=3 127 B22R2.8322 BrCCCCCOCc1ccccc1Oc2ccccc2 7a_100000746331_100000199117 [0,1,0,0,0,0|3,0,0]=4 128 B22R2.8322 C#CCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100012094781 [0,1,0,0,0,0|2,0,1]=4 129 B22R2.8322 C#CCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100012094781 [0,1,0,0,0,0|2,0,1]=4 130 B22R2.8322 C#CCCCCCSc1ccccc1Cc2ccccc2 62a_100012094781_200011216382 [0,1,0,0,0,0|1,1,1]=4 131 B22R2.8322 C#CCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100012094781 [0,1,0,0,0,0|1,1,1]=4 132 B22R2.8322 C#CCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100010269958 [0,1,0,0,0,0|1,1,1]=4 133 B22R2.8322 C#CCCCCSCc1ccccc1Cc2ccccc2 62a_100010269958_100010254464 [0,1,0,0,0,0|1,1,1]=4 134 B22R2.8322 C=CCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000700193 [0,1,0,0,0,0|2,0,1]=4 135 B22R2.8322 C=CCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000700193 [0,1,0,0,0,0|2,0,1]=4 136 B22R2.8322 C=CCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000700193 [0,1,0,0,0,0|2,0,1]=4 137 B22R2.8322 C=CCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000700193 [0,1,0,0,0,0|1,0,1]=3 138 B22R2.8322 C=CCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000700193 [0,1,0,0,0,0|1,0,1]=3 139 B22R2.8322 C=CCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000700193 [0,1,0,0,0,0|2,0,1]=4 140 B22R2.8322 C=CCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000700193 [0,1,0,0,0,0|2,0,1]=4 141 B22R2.8322 C=CCCCCOCc1ccccc1Cc2ccccc2 34a_100000766645_100010254464 [0,1,0,0,0,0|1,0,1]=3 142 B22R2.8322 C=CCCCCOCc1ccccc1Cc2ccccc2 7a_100000766645_100010254464 [0,1,0,0,0,0|1,0,1]=3 143 B22R2.8322 C=CCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100011215482 [0,1,0,0,0,0|2,0,1]=4 144 B22R2.8322 C=CCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100011215482 [0,1,0,0,0,0|2,0,1]=4 145 B22R2.8322 C=CCCCCOCc1ccccc1Oc2ccccc2 7a_100000766645_100000199117 [0,1,0,0,0,0|2,0,1]=4 146 B22R2.8322 C=CCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011215482 [0,1,0,0,0,0|1,1,1]=4 147 B22R2.8322 C=CCCCCSCc1ccccc1Cc2ccccc2 62a_100011215482_100010254464 [0,1,0,0,0,0|1,1,1]=4 148 B22R2.8322 CC/C=C\CCOCc1ccccc1Cc2ccccc2 34a_100016288707_100010254464 [0,1,0,0,0,0|1,0,2]=4 149 B22R2.8322 CC/C=C\CCOCc1ccccc1Cc2ccccc2 7a_100016288707_100010254464 [0,1,0,0,0,0|1,0,2]=4 150 B22R2.8322 CC=CCCCOCc1ccccc1Cc2ccccc2 34a_100020645299_100010254464 [0,1,0,0,0,0|1,0,1]=3 151 B22R2.8322 CCC/C=C/COCc1ccccc1Cc2ccccc2 34a_100016278788_100010254464 [0,1,0,0,0,0|1,0,2]=4 152 B22R2.8322 CCC/C=C/COCc1ccccc1Cc2ccccc2 7a_100016278788_100010254464 [0,1,0,0,0,0|1,0,2]=4 153 B22R2.8322 CCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000210681 [0,1,0,0,0,0|2,0,0]=3 154 B22R2.8322 CCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000210614 [0,1,0,0,0,0|2,0,0]=3 155 B22R2.8322 CCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000210614 [0,1,0,0,0,0|2,0,0]=3 156 B22R2.8322 CCCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100000210681 [0,1,0,0,0,0|3,0,0]=4 157 B22R2.8322 CCCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100000210614 [0,1,0,0,0,0|3,0,0]=4 158 B22R2.8322 CCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000210614 [0,1,0,0,0,0|1,0,0]=2 159 B22R2.8322 CCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000210614 [0,1,0,0,0,0|1,0,0]=2 160 B22R2.8322 CCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000210614 [0,1,0,0,0,0|2,0,0]=3 161 B22R2.8322 CCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000210614 [0,1,0,0,0,0|2,0,0]=3 162 B22R2.8322 CCCCCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100000210614 [0,1,0,0,0,0|3,0,0]=4 163 B22R2.8322 CCCCCCNCc1ccccc1Oc2ccccc2 207a_100000210581_100011234122 [0,1,0,0,0,0|3,0,0]=4 164 B22R2.8322 CCCCCCNCc1ccccc1Oc2ccccc2 2230a_100000210581_100000199117 [0,1,0,0,0,0|3,0,0]=4 165 B22R2.8322 CCCCCCNCc1ccccc1Oc2ccccc2 2230a_100016987831_100000210314 [0,1,0,0,0,0|3,0,0]=4 166 B22R2.8322 CCCCCCNCc1ccccc1Oc2ccccc2 270004a_100000210581_100011234122 [0,1,0,0,0,0|3,0,0]=4 167 B22R2.8322 CCCCCCNCc1ccccc1Oc2ccccc2 34a_100016987831_100000210314 [0,1,0,0,0,0|3,0,0]=4 168 B22R2.8322 CCCCCCOCc1ccccc1Cc2ccccc2 34a_100000210259_100010254464 [0,1,0,0,0,0|1,0,0]=2 169 B22R2.8322 CCCCCCOCc1ccccc1Cc2ccccc2 7a_100000210259_100010254464 [0,1,0,0,0,0|1,0,0]=2 170 B22R2.8322 CCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000210314 [0,1,0,0,0,0|2,0,0]=3 171 B22R2.8322 CCCCCCOCc1ccccc1Oc2ccccc2 7a_100000210259_100000199117 [0,1,0,0,0,0|2,0,0]=3 172 B22R2.8322 CCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000210314 [0,1,0,0,0,0|2,0,0]=3 173 B22R2.8322 CCCCOCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000743108 [0,1,0,0,0,0|3,0,0]=4 174 B22R2.8322 CCCCOCCSc1ccccc1Cc2ccccc2 62a_100000743108_200011216382 [0,1,0,0,0,0|1,1,0]=3 175 B22R2.8322 CCCCOCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000743108 [0,1,0,0,0,0|1,1,0]=3 176 B22R2.8322 CCCCOCCSc1ccccc1Nc2ccccc2 62a_100000743108_100009815782 [0,1,0,0,0,0|2,1,0]=4 177 B22R2.8322 CCCCOCCSc1ccccc1Oc2ccccc2 62a_100000743108_100000049502 [0,1,0,0,0,0|2,1,0]=4 178 B22R2.8322 CCCCOCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011995733 [0,1,0,0,0,0|2,1,0]=4 179 B22R2.8322 CCCCOCSCc1ccccc1Cc2ccccc2 62a_100011995733_100010254464 [0,1,0,0,0,0|2,1,0]=4 180 B22R2.8322 CCCSCCOCc1ccccc1Oc2ccccc2 7a_200000230433_100000199117 [0,1,0,0,0,0|3,0,0]=4 181 B22R2.8322 CCSCCCOCc1ccccc1Oc2ccccc2 7a_100011216438_100000199117 [0,1,0,0,0,0|3,0,0]=4 182 B22R2.8322 COCCCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000730899 [0,1,0,0,0,0|2,1,0]=4 183 B22R2.8322 COCCCCSCc1ccccc1Oc2ccccc2 62a_100000730899_100000199117 [0,1,0,0,0,0|2,1,0]=4 184 B22R2.8322 CSCCCCOCc1ccccc1Oc2ccccc2 7a_100011217163_100000199117 [0,1,0,0,0,0|2,0,0]=3 185 B22R2.8322 ClCCCCCOCc1ccccc1Cc2ccccc2 34a_100000746330_100010254464 [0,1,0,0,0,0|2,0,0]=3 186 B22R2.8322 ClCCCCCOCc1ccccc1Cc2ccccc2 7a_100000746330_100010254464 [0,1,0,0,0,0|2,0,0]=3 187 B22R2.8322 ClCCCCCOCc1ccccc1Oc2ccccc2 7a_100000746330_100000199117 [0,1,0,0,0,0|3,0,0]=4 188 B22R2.8322 FCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100015922095 [0,1,0,0,0,0|2,0,0]=3 189 B22R2.8322 FCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100015922095 [0,1,0,0,0,0|2,0,0]=3 190 B22R2.8322 FCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100015922095 [0,1,0,0,0,0|2,0,0]=3 191 B22R2.8322 FCCCCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100015922095 [0,1,0,0,0,0|3,0,0]=4 192 B22R2.8322 FCCCCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100015922095 [0,1,0,0,0,0|3,0,0]=4 193 B22R2.8322 FCCCCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100015922095 [0,1,0,0,0,0|3,0,0]=4 194 B22R2.8322 FCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100015922095 [0,1,0,0,0,0|1,0,0]=2 195 B22R2.8322 FCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100015922095 [0,1,0,0,0,0|1,0,0]=2 196 B22R2.8322 FCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100015922095 [0,1,0,0,0,0|2,0,0]=3 197 B22R2.8322 FCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100015922095 [0,1,0,0,0,0|2,0,0]=3 198 B22R2.8322 FCCCCCCSc1ccccc1Cc2ccccc2 62a_100015922095_200011216382 [0,1,0,0,0,0|1,1,0]=3 199 B22R2.8322 FCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100015922095 [0,1,0,0,0,0|1,1,0]=3 200 B22R2.8322 FCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000729378 [0,1,0,0,0,0|3,0,0]=4 201 B22R2.8322 FCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000729378 [0,1,0,0,0,0|3,0,0]=4 202 B22R2.8322 FCCCCCSCc1ccccc1Cc2ccccc2 62a_100000729378_100010254464 [0,1,0,0,0,0|2,1,0]=4 203 B22R2.8322 FCCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000729378 [0,1,0,0,0,0|2,1,0]=4 204 B22R2.8322 ICCCCCOCc1ccccc1Cc2ccccc2 34a_200012148887_100010254464 [0,1,0,0,0,0|2,0,0]=3 205 B22R2.8322 ICCCCCOCc1ccccc1Cc2ccccc2 7a_200012148887_100010254464 [0,1,0,0,0,0|2,0,0]=3 206 B22R2.8322 ICCCCCOCc1ccccc1Oc2ccccc2 7a_200012148887_100000199117 [0,1,0,0,0,0|3,0,0]=4 207 B22R2.8322 N#CCCCCCSc1ccccc1Cc2ccccc2 62a_100009813376_200011216382 [0,1,0,0,0,0|1,1,1]=4 208 B22R2.8322 N#CCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100009813376 [0,1,0,0,0,0|1,1,1]=4 209 B22R2.8322 N#CCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000211819 [0,1,0,0,0,0|2,1,0]=4 210 B22R2.8322 N#CCCCCSCc1ccccc1Cc2ccccc2 62a_100011219923_100010254464 [0,1,0,0,0,0|2,1,0]=4 211 B22R2.8322 O=CCCCCCSc1ccccc1Cc2ccccc2 62a_100000139337_200011216382 [0,1,0,0,0,0|1,1,1]=4 212 B22R2.8322 O=CCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000139337 [0,1,0,0,0,0|1,1,1]=4 213 B22R2.8322 OCCCCCCSc1ccccc1Nc2ccccc2 62a_100000766143_100009815782 [0,1,0,0,0,0|2,1,0]=4 214 B22R2.8322 OCCCCCCSc1ccccc1Oc2ccccc2 62a_100000766143_100000049502 [0,1,0,0,0,0|2,1,0]=4 215 B22R2.15248 CC(=O)CCCCSc1ccccc1Cc2ccccc2 62a_100000735457_200011216382 [0,1,0,0,0,0|1,1,0]=3 216 B22R2.15248 CC(=O)CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000735457 [0,1,0,0,0,0|1,1,0]=3 217 B22R2.15248 CC(=O)CCCCSc1ccccc1Nc2ccccc2 62a_100000735457_100009815782 [0,1,0,0,0,0|2,1,0]=4 218 B22R2.15248 CC(=O)CCCCSc1ccccc1Oc2ccccc2 62a_100000735457_100000049502 [0,1,0,0,0,0|2,1,0]=4 219 B22R2.15248 CC(=O)SCCCSc1ccccc1Cc2ccccc2 62a_100000038929_200011216382 [0,1,0,0,0,0|2,1,0]=4 220 B22R2.15248 CC(=O)SCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000038929 [0,1,0,0,0,0|2,1,0]=4 221 B22R2.15248 CC(=S)OCCCSc1ccccc1Cc2ccccc2 62a_200011216382_200135323944 [0,1,0,0,0,0|2,1,0]=4 222 B22R2.15248 CC(=S)OCCCSc1ccccc1Cc2ccccc2 62a_200135323944_200011216382 [0,1,0,0,0,0|2,1,0]=4 223 B22R2.15248 CC(C)CCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011216152 [0,1,0,0,0,0|2,0,0]=3 224 B22R2.15248 CC(C)CCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011216152 [0,1,0,0,0,0|2,0,0]=3 225 B22R2.15248 CC(C)CCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011216152 [0,1,0,0,0,0|2,0,0]=3 226 B22R2.15248 CC(C)CCCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011216152 [0,1,0,0,0,0|3,0,0]=4 227 B22R2.15248 CC(C)CCCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011216152 [0,1,0,0,0,0|3,0,0]=4 228 B22R2.15248 CC(C)CCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011216152 [0,1,0,0,0,0|1,0,0]=2 229 B22R2.15248 CC(C)CCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011216152 [0,1,0,0,0,0|1,0,0]=2 230 B22R2.15248 CC(C)CCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011216152 [0,1,0,0,0,0|2,0,0]=3 231 B22R2.15248 CC(C)CCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011216152 [0,1,0,0,0,0|2,0,0]=3 232 B22R2.15248 CC(C)CCCCOc1ccccc1Oc2ccccn2 34a_100000748224_100011216152 [0,1,0,0,0,0|3,0,0]=4 233 B22R2.15248 CC(C)CCCOCc1ccccc1Cc2ccccc2 34a_100000210774_100010254464 [0,1,0,0,0,0|3,0,0]=4 234 B22R2.15248 CC(C)CCCOCc1ccccc1Cc2ccccc2 7a_100000210774_100010254464 [0,1,0,0,0,0|3,0,0]=4 235 B22R2.15248 CC(C)CCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100011214892 [0,1,0,0,0,0|3,0,0]=4 236 B22R2.15248 CC(C)CCCSCc1ccccc1Cc2ccccc2 62a_100011214892_100010254464 [0,1,0,0,0,0|3,0,0]=4 237 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)C 2230a_100000184146_100000210314 [0,1,0,0,0,0|3,0,0]=4 238 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)C 34a_100000184146_100000210314 [0,1,0,0,0,0|3,0,0]=4 239 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)C 7a_100000184146_100000210314 [0,1,0,0,0,0|3,0,0]=4 240 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)F 2230a_100000743720_100000210314 [0,1,0,0,0,0|3,0,0]=4 241 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)F 34a_100000743720_100000210314 [0,1,0,0,0,0|3,0,0]=4 242 B22R2.26330 CCCCCCNc1ccccc1Oc2cccc(c2)F 7a_100000743720_100000210314 [0,1,0,0,0,0|3,0,0]=4 243 B22R2.27057 CCC(C)CCOCc1ccccc1Cc2ccccc2 7a_100011215188_100010254464 [0,1,0,0,0,0|3,0,0]=4 244 B22R2.28715 CCCCCCNc1ccccc1Oc2ccc(cc2)C 34a_100025771381_100000210314 [0,1,0,0,0,0|3,0,0]=4 245 B22R2.28715 CCCCCCNc1ccccc1Oc2ccc(cc2)F 2230a_100011202611_100000210314 [0,1,0,0,0,0|3,0,0]=4 246 B22R2.28715 CCCCCCNc1ccccc1Oc2ccc(cc2)F 34a_100011202611_100000210314 [0,1,0,0,0,0|3,0,0]=4 247 B22R2.28715 CCCCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000210314 [0,1,0,0,0,0|3,0,0]=4 248 B22R2.28715 COCCCCNc1ccccc1Sc2ccc(cc2)Cl 2230a_100000211321_100000730899 [0,1,0,0,0,0|3,0,0]=4 249 B22R2.28715 COCCCCSc1ccccc1Oc2ccc(cc2)F 62a_100000730899_200010782033 [0,1,0,0,0,0|2,1,0]=4 250 B22R2.28715 COCCCCSc1ccccc1Oc2ccc(cc2)F 62a_200010782033_100000730899 [0,1,0,0,0,0|2,1,0]=4 251 B22R2.29090 C#CCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100010269958 [0,1,0,0,0,0|1,0,1]=3 252 B22R2.29090 C#CCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100010269958 [0,1,0,0,0,0|1,0,1]=3 253 B22R2.29090 C=CCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100011215482 [0,1,0,0,0,0|1,0,1]=3 254 B22R2.29090 C=CCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100011215482 [0,1,0,0,0,0|1,0,1]=3 255 B22R2.29090 CC/C=C\CCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100015370543 [0,1,0,0,0,0|1,0,2]=4 256 B22R2.29090 CC/C=C\CCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100015370543 [0,1,0,0,0,0|1,0,2]=4 257 B22R2.29090 CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000210314 [0,1,0,0,0,0|1,0,0]=2 258 B22R2.29090 CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000210314 [0,1,0,0,0,0|1,0,0]=2 259 B22R2.29090 CCCCOCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100011995733 [0,1,0,0,0,0|2,0,0]=3 260 B22R2.29090 FCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000729378 [0,1,0,0,0,0|2,0,0]=3 261 B22R2.29090 FCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000729378 [0,1,0,0,0,0|2,0,0]=3 262 B22R2.29090 N#CCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000211819 [0,1,0,0,0,0|2,0,0]=3 263 B22R2.29741 CCCCC(C)OCc1ccccc1Cc2ccccc2 34a_100000687866_100010254464 [0,1,0,0,0,0|3,0,0]=4 264 B22R2.29741 CCCCC(C)OCc1ccccc1Cc2ccccc2 7a_100000687866_100010254464 [0,1,0,0,0,0|3,0,0]=4 265 B22R2.30740 CCCC(C)COCc1ccccc1Cc2ccccc2 34a_100000688023_100010254464 [0,1,0,0,0,0|3,0,0]=4 266 B22R2.30740 CCCC(C)COCc1ccccc1Cc2ccccc2 7a_100000688023_100010254464 [0,1,0,0,0,0|3,0,0]=4 267 B22R2.30740 CCCC(C)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100011216630 [0,1,0,0,0,0|3,0,0]=4 268 B22R2.30740 CCCC(C)CSCc1ccccc1Cc2ccccc2 62a_100011216630_100010254464 [0,1,0,0,0,0|3,0,0]=4 269 B22R2.51608 C=CCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100011215482 [0,1,0,0,0,0|2,0,1]=4 270 B22R2.51608 CCCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000210757 [0,1,0,0,0,0|2,0,0]=3 271 B22R2.51608 CCCCCCC(=O)c1ccccc1Oc2ccccc2 1458a_100000185727_100000210757 [0,1,0,0,0,0|3,0,0]=4 272 B22R2.51608 CCCCCCC(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_100000210757 [0,1,0,0,0,0|3,0,0]=4 273 B22R2.572292 CCCCCCNc1cc(ccc1Oc2ccccc2)F 2230a_100000750978_100000210314 [0,1,0,0,0,0|3,0,0]=4 274 B22R2.572292 CCCCCCNc1cc(ccc1Oc2ccccc2)F 34a_100000750978_100000210314 [0,1,0,0,0,0|3,0,0]=4 275 B22R2.572292 CCCCCCNc1cc(ccc1Oc2ccccc2)F 7a_100000750978_100000210314 [0,1,0,0,0,0|3,0,0]=4 276 B22R2.572334 C=CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100011215482 [0,1,0,0,0,0|1,1,1]=4 277 B22R2.572334 C=CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011215482_100011211563 [0,1,0,0,0,0|1,1,1]=4 278 B22R2.572334 CCCCCC=Cc1ccccc1C(N)c2ccccc2 271570a_100000062253_100011211563 [0,1,0,0,0,0|2,0,1]=4 279 B22R2.572334 CCCCCCSc1ccccc1C(=O)c2ccccc2 62a_100000198044_100000210757 [0,1,0,0,0,0|1,1,1]=4 280 B22R2.572334 CCCCCCSc1ccccc1C(N)c2ccccc2 62a_100000210314_100011211563 [0,1,0,0,0,0|1,1,0]=3 281 B22R2.572334 CCCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000210757 [0,1,0,0,0,0|1,1,0]=3 282 B22R2.572670 CCCCCCNc1ccccc1Oc2ccccc2C 2230a_100000188859_100000210314 [0,1,0,0,0,0|3,0,0]=4 283 B22R2.572670 CCCCCCNc1ccccc1Oc2ccccc2C 34a_100000188859_100000210314 [0,1,0,0,0,0|3,0,0]=4 284 B22R2.572670 CCCCCCNc1ccccc1Oc2ccccc2C 7a_100000188859_100000210314 [0,1,0,0,0,0|3,0,0]=4 285 B22R3.3729 C1=CC(CCC1)Sc2ccccc2Cc3ccccc3 62a_100000751183_200011216382 [0,0,0,1,0,0|1,1,1]=4 286 B22R3.3729 C1=CC(CCC1)Sc2ccccc2Cc3ccccc3 62a_200011216382_100000751183 [0,0,0,1,0,0|1,1,1]=4 287 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCCCC3 34a_100000211252_100000210327 [0,0,0,1,0,0|2,0,0]=3 288 B22R3.3729 c1ccc(cc1)Cc2ccccc2NC3CCCCC3 7a_100000211252_100000210327 [0,0,0,1,0,0|2,0,0]=3 289 B22R3.3729 c1ccc(cc1)Cc2ccccc2SC3CCCCC3 62a_100000210327_200011216382 [0,0,0,1,0,0|1,1,0]=3 290 B22R3.3729 c1ccc(cc1)Cc2ccccc2SC3CCCCC3 62a_200011216382_100000210327 [0,0,0,1,0,0|1,1,0]=3 291 B22R3.3729 c1ccc(cc1)Cc2ccccc2SC3CCSCC3 62a_200011216382_100000069128 [0,0,0,1,0,0|2,1,0]=4 292 B22R3.3729 c1ccc(cc1)Nc2ccccc2SC3CCCCC3 62a_100000210327_100009815782 [0,0,0,1,0,0|2,1,0]=4 293 B22R3.3729 c1ccc(cc1)Oc2ccccc2NC3CCCCC3 34a_100000182328_100000210327 [0,0,0,1,0,0|3,0,0]=4 294 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCCCC3 34a_100000074787_100000210327 [0,0,0,1,0,0|2,0,0]=3 295 B22R3.3729 c1ccc(cc1)Oc2ccccc2OC3CCCCC3 7a_100000074787_100000210327 [0,0,0,1,0,0|2,0,0]=3 296 B22R3.3729 c1ccc(cc1)Oc2ccccc2SC3CCCCC3 62a_100000210327_100000049502 [0,0,0,1,0,0|2,1,0]=4 297 B22R3.3729 c1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_100000719477_200011235867 [0,0,0,1,0,0|2,0,0]=3 298 B22R3.3729 c1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000041952 [0,0,0,1,0,0|2,0,0]=3 299 B22R3.3730 c1ccc(cc1)Cc2ccccc2CSC3CCCC3 62a_100010254464_100000179811 [0,0,0,1,0,0|3,0,0]=4 300 B22R3.3730 c1ccc(cc1)Cc2ccccc2CSC3CCCC3 62a_100011217020_100010254464 [0,0,0,1,0,0|3,0,0]=4 301 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCCC3 62a_100000740388_200011216382 [0,0,0,1,0,0|1,1,0]=3 302 B22R3.3730 c1ccc(cc1)Cc2ccccc2SCC3CCCC3 62a_200011216382_100000740388 [0,0,0,1,0,0|1,1,0]=3 303 B22R3.3730 c1ccc(cc1)Nc2ccccc2SCC3CCCC3 62a_100000740388_100009815782 [0,0,0,1,0,0|2,1,0]=4 304 B22R3.3730 c1ccc(cc1)Oc2ccccc2NCC3CCCC3 2230a_100000182328_100000740388 [0,0,0,1,0,0|3,0,0]=4 305 B22R3.3730 c1ccc(cc1)Oc2ccccc2NCC3CCCC3 34a_100000182328_100000740388 [0,0,0,1,0,0|3,0,0]=4 306 B22R3.3730 c1ccc(cc1)Oc2ccccc2OCC3CCCC3 34a_100000074787_100000740388 [0,0,0,1,0,0|2,0,0]=3 307 B22R3.3730 c1ccc(cc1)Oc2ccccc2OCC3CCCC3 7a_100000074787_100000740388 [0,0,0,1,0,0|2,0,0]=3 308 B22R3.3730 c1ccc(cc1)Oc2ccccc2SCC3CCCC3 62a_100000740388_100000049502 [0,0,0,1,0,0|2,1,0]=4 309 B22R3.3730 c1ccc(cc1)Sc2ccccc2NCC3CCCC3 2230a_100000210917_100000740388 [0,0,0,1,0,0|3,0,0]=4 310 B22R3.74329 c1ccc(cc1)Cc2ccccc2CSCCC3CC3 62a_100000764125_100010254464 [0,0,0,1,0,0|3,0,0]=4 311 B22R3.74329 c1ccc(cc1)Cc2ccccc2CSCCC3CC3 62a_100010254464_100000764125 [0,0,0,1,0,0|3,0,0]=4 312 B22R3.74330 c1ccc(cc1)Cc2ccccc2CSCC3CCC3 62a_100000763275_100010254464 [0,0,0,1,0,0|3,0,0]=4 313 B22R3.74330 c1ccc(cc1)Cc2ccccc2CSCC3CCC3 62a_100010254464_100000763275 [0,0,0,1,0,0|3,0,0]=4 314 B22R3.98916 C=CCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100011215482 [0,0,0,1,0,0|2,0,1]=4 315 B22R3.98916 C=CCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100011215482 [0,0,0,1,0,0|2,0,1]=4 316 B22R3.98916 CCCCCCNc1cccc2c1oc3c2cccc3 34a_200000102501_100000210314 [0,0,0,1,0,0|3,0,0]=4 317 B22R3.98916 CCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000210314 [0,0,0,1,0,0|2,0,0]=3 318 B22R3.98916 CCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000210314 [0,0,0,1,0,0|2,0,0]=3 319 B22R3.98916 FCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000729378 [0,0,0,1,0,0|3,0,0]=4 320 B22R3.98916 FCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000729378 [0,0,0,1,0,0|3,0,0]=4 321 B22R3.1415314 C1=C(CCCCC1)c2ccccc2Cc3ccccc3 271570a_200009888920_200011216382 [0,0,0,1,0,0|2,0,1]=4 322 B20R2.2589 C#CCCCCSc1ccccc1c2ccccc2 62a_100000033479_100010269958 [0,0,0,0,1,0|1,1,1]=4 323 B20R2.2589 C#CCCCCSc1ccccc1c2ccccc2 62a_100010269958_100000033479 [0,0,0,0,1,0|1,1,1]=4 324 B20R2.2589 C=CCCCCNc1ccccc1c2ccccc2 34a_100000210918_100011215482 [0,0,0,0,1,0|2,0,1]=4 325 B20R2.2589 C=CCCCCOc1ccccc1c2ccccc2 34a_100000210297_100011215482 [0,0,0,0,1,0|1,0,1]=3 326 B20R2.2589 C=CCCCCOc1ccccc1c2ccccc2 7a_100000210297_100011215482 [0,0,0,0,1,0|1,0,1]=3 327 B20R2.2589 C=CCCCCSc1ccccc1c2ccccc2 62a_100000033479_100011215482 [0,0,0,0,1,0|1,1,1]=4 328 B20R2.2589 C=CCCCCSc1ccccc1c2ccccc2 62a_100011215482_100000033479 [0,0,0,0,1,0|1,1,1]=4 329 B20R2.2589 CC/C=C\CCOc1ccccc1c2ccccc2 34a_100000210297_100015370543 [0,0,0,0,1,0|1,0,2]=4 330 B20R2.2589 CC/C=C\CCOc1ccccc1c2ccccc2 7a_100000210297_100015370543 [0,0,0,0,1,0|1,0,2]=4 331 B20R2.2589 CCCCCC=Cc1ccccc1c2ccccc2 271570a_100000062253_100000033479 [0,0,0,0,1,0|2,0,1]=4 332 B20R2.2589 CCCCCCNc1ccccc1c2[c-]cccc2 34a_107093835030_100000210314 [0,0,0,0,1,0|2,0,1]=4 333 B20R2.2589 CCCCCCNc1ccccc1c2[c-]cccc2 7a_107093835030_100000210314 [0,0,0,0,1,0|2,0,1]=4 334 B20R2.2589 CCCCCCNc1ccccc1c2ccccc2 34a_100000210918_100000210314 [0,0,0,0,1,0|2,0,0]=3 335 B20R2.2589 CCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100000210314 [0,0,0,0,1,0|1,0,0]=2 336 B20R2.2589 CCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100000210314 [0,0,0,0,1,0|1,0,0]=2 337 B20R2.2589 CCCCCCSc1ccccc1c2ccccn2 62a_100000210314_100010202516 [0,0,0,0,1,0|2,1,0]=4 338 B20R2.2589 CCCCCCSc1ccccc1c2ccccn2 62a_100010202516_100000210757 [0,0,0,0,1,0|2,1,0]=4 339 B20R2.2589 CCCCCCSc1ccccc1c2ccncc2 62a_100000210314_100010154595 [0,0,0,0,1,0|2,1,0]=4 340 B20R2.2589 CCCCCCSc1ccccc1c2ccncc2 62a_100010154595_100000210757 [0,0,0,0,1,0|2,1,0]=4 341 B20R2.2589 CCCCCCSc1cccnc1c2ccccc2 62a_100000210314_100010138707 [0,0,0,0,1,0|2,1,0]=4 342 B20R2.2589 CCCCCCSc1cccnc1c2ccccc2 62a_100010138707_100000210757 [0,0,0,0,1,0|2,1,0]=4 343 B20R2.2589 CCCCCCSc1cnccc1c2ccccc2 62a_100000210314_100009816686 [0,0,0,0,1,0|2,1,0]=4 344 B20R2.2589 CCCCCCSc1cnccc1c2ccccc2 62a_100009816686_100000210757 [0,0,0,0,1,0|2,1,0]=4 345 B20R2.2589 CCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100000718602 [0,0,0,0,1,0|3,0,0]=4 346 B20R2.2589 CCCCCOCc1ccccc1c2ccccc2 34a_100000210253_100009813379 [0,0,0,0,1,0|3,0,0]=4 347 B20R2.2589 CCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000210326 [0,0,0,0,1,0|3,0,0]=4 348 B20R2.2589 CCCCCOCc1ccccc1c2ccccc2 7a_100000210253_100009813379 [0,0,0,0,1,0|3,0,0]=4 349 B20R2.2589 CCCCCSCc1ccccc1c2ccccc2 62a_100000210326_100009813379 [0,0,0,0,1,0|3,0,0]=4 350 B20R2.2589 CCCCCSCc1ccccc1c2ccccc2 62a_100009813379_100000210326 [0,0,0,0,1,0|3,0,0]=4 351 B20R2.2589 CCCCOCSc1ccccc1c2ccccc2 62a_100000033479_100011995733 [0,0,0,0,1,0|2,1,0]=4 352 B20R2.2589 CCCCOCSc1ccccc1c2ccccc2 62a_100011995733_100000033479 [0,0,0,0,1,0|2,1,0]=4 353 B20R2.2589 FCCCCCSc1ccccc1c2ccccc2 62a_100000033479_100000729378 [0,0,0,0,1,0|2,1,0]=4 354 B20R2.2589 FCCCCCSc1ccccc1c2ccccc2 62a_100000729378_100000033479 [0,0,0,0,1,0|2,1,0]=4 355 B20R2.2589 N#CCCCCSc1ccccc1c2ccccc2 62a_100000033479_100000211819 [0,0,0,0,1,0|2,1,0]=4 356 B20R2.2589 N#CCCCCSc1ccccc1c2ccccc2 62a_100011219923_100000033479 [0,0,0,0,1,0|2,1,0]=4 357 B22R2.26331 C#CCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100010269958 [0,0,0,0,0,1|2,0,1]=4 358 B22R2.26331 C#CCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100010269958 [0,0,0,0,0,1|2,0,1]=4 359 B22R2.26331 C#CCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100010269958 [0,0,0,0,0,1|1,1,1]=4 360 B22R2.26331 C#CCCCCSc1ccccc1OCc2ccccc2 62a_100010269958_100000151716 [0,0,0,0,0,1|1,1,1]=4 361 B22R2.26331 C=CCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011215482 [0,0,0,0,0,1|2,0,1]=4 362 B22R2.26331 C=CCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100011215482 [0,0,0,0,0,1|2,0,1]=4 363 B22R2.26331 C=CCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100011215482 [0,0,0,0,0,1|2,0,1]=4 364 B22R2.26331 C=CCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011215482 [0,0,0,0,0,1|2,0,1]=4 365 B22R2.26331 C=CCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100011215482 [0,0,0,0,0,1|2,0,1]=4 366 B22R2.26331 C=CCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100011215482 [0,0,0,0,0,1|2,0,1]=4 367 B22R2.26331 C=CCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100011215482 [0,0,0,0,0,1|1,0,1]=3 368 B22R2.26331 C=CCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011215482 [0,0,0,0,0,1|1,0,1]=3 369 B22R2.26331 C=CCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100011215482 [0,0,0,0,0,1|1,1,1]=4 370 B22R2.26331 C=CCCCCSc1ccccc1OCc2ccccc2 62a_100011215482_100000151716 [0,0,0,0,0,1|1,1,1]=4 371 B22R2.26331 CC/C=C\CCOc1ccccc1OCc2ccccc2 34a_100000187230_100015370543 [0,0,0,0,0,1|1,0,2]=4 372 B22R2.26331 CC/C=C\CCOc1ccccc1OCc2ccccc2 7a_100000187230_100015370543 [0,0,0,0,0,1|1,0,2]=4 373 B22R2.26331 CCCCCC=Cc1ccccc1OCc2ccccc2 271570a_100000062253_100000151716 [0,0,0,0,0,1|2,0,1]=4 374 B22R2.26331 CCCCCCNc1ccccc1C#Cc2ccccc2 2230a_100000044502_100000210314 [0,0,0,0,0,1|2,0,1]=4 375 B22R2.26331 CCCCCCNc1ccccc1C#Cc2ccccc2 34a_100000044502_100000210314 [0,0,0,0,0,1|2,0,1]=4 376 B22R2.26331 CCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000210314 [0,0,0,0,0,1|2,0,0]=3 377 B22R2.26331 CCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000210314 [0,0,0,0,0,1|2,0,0]=3 378 B22R2.26331 CCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000210314 [0,0,0,0,0,1|2,0,0]=3 379 B22R2.26331 CCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000210314 [0,0,0,0,0,1|2,0,0]=3 380 B22R2.26331 CCCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000210314 [0,0,0,0,0,1|2,0,0]=3 381 B22R2.26331 CCCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000210314 [0,0,0,0,0,1|2,0,0]=3 382 B22R2.26331 CCCCCCOc1ccccc1C=Cc2ccccn2 34a_200021180701_100000210314 [0,0,0,0,0,1|2,0,1]=4 383 B22R2.26331 CCCCCCOc1ccccc1CNc2ccccc2 207a_100000106764_200000189357 [0,0,0,0,0,1|1,0,0]=2 384 B22R2.26331 CCCCCCOc1ccccc1CNc2ccccc2 270302a_100000106764_200000189357 [0,0,0,0,0,1|1,0,0]=2 385 B22R2.26331 CCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000210314 [0,0,0,0,0,1|1,0,0]=2 386 B22R2.26331 CCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000210314 [0,0,0,0,0,1|1,0,0]=2 387 B22R2.26331 CCCCCCSc1ccccc1C#Cc2ccccc2 62a_100000210314_100010200916 [0,0,0,0,0,1|1,1,1]=4 388 B22R2.26331 CCCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000210757 [0,0,0,0,0,1|1,1,0]=3 389 B22R2.26331 CCCCCCSc1ccccc1OCc2ccccc2 62a_100000210314_100000151716 [0,0,0,0,0,1|1,1,0]=3 390 B22R2.26331 CCCCCCSc1cccnc1OCc2ccccc2 62a_100000210314_200011465151 [0,0,0,0,0,1|2,1,0]=4 391 B22R2.26331 CCCCCCSc1cccnc1OCc2ccccc2 62a_200011465151_100000210757 [0,0,0,0,0,1|2,1,0]=4 392 B22R2.26331 CCCCCCSc1ncccc1OCc2ccccc2 62a_100000210314_100011501402 [0,0,0,0,0,1|2,1,0]=4 393 B22R2.26331 CCCCCCSc1ncccc1OCc2ccccc2 62a_100011501402_100000210757 [0,0,0,0,0,1|2,1,0]=4 394 B22R2.26331 CCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000718602 [0,0,0,0,0,1|3,0,0]=4 395 B22R2.26331 CCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000210326 [0,0,0,0,0,1|3,0,0]=4 396 B22R2.26331 CCCCOCNc1ccccc1SCc2ccccc2 34a_100000198535_100011995733 [0,0,0,0,0,1|3,0,0]=4 397 B22R2.26331 CCCCOCSc1ccccc1OCc2ccccc2 62a_100000151716_100011995733 [0,0,0,0,0,1|2,1,0]=4 398 B22R2.26331 CCCCOCSc1ccccc1OCc2ccccc2 62a_100011995733_100000151716 [0,0,0,0,0,1|2,1,0]=4 399 B22R2.26331 FCCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000729378 [0,0,0,0,0,1|3,0,0]=4 400 B22R2.26331 FCCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000729378 [0,0,0,0,0,1|3,0,0]=4 401 B22R2.26331 FCCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000729378 [0,0,0,0,0,1|2,1,0]=4 402 B22R2.26331 FCCCCCSc1ccccc1OCc2ccccc2 62a_100000729378_100000151716 [0,0,0,0,0,1|2,1,0]=4 403 B22R2.26331 N#CCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000211819 [0,0,0,0,0,1|3,0,0]=4 404 B22R2.26331 N#CCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000211819 [0,0,0,0,0,1|2,1,0]=4 405 B22R2.26331 N#CCCCCSc1ccccc1OCc2ccccc2 62a_100011219923_100000151716 [0,0,0,0,0,1|2,1,0]=4 406 B19R2.8977 CCCC=Cc1ccccc1Cc2ccccc2 271570a_100016258520_200011216382 [2,0,0,0,0,0|0,0,2]=4 407 B19R2.8977 CCCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100000210211 [2,0,0,0,0,0|2,0,0]=4 408 B19R2.8977 CCCCOc1ccccc1Sc2ccccc2 62a_100000230755_100000041952 [2,0,0,0,0,0|1,0,0]=3 409 B19R2.8977 CCCCOc1ccccc1Sc2ccccc2 62a_100000719477_100000230755 [2,0,0,0,0,0|1,0,0]=3 410 B19R2.8977 CCCCSc1ccccc1Cc2ccccc2 62a_100000210211_200011216382 [2,0,0,0,0,0|0,1,0]=3 411 B19R2.8977 CCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000210210 [2,0,0,0,0,0|0,1,0]=3 412 B19R2.8977 CCCCSc1ccccc1Nc2ccccc2 62a_100000210211_100009815782 [2,0,0,0,0,0|1,1,0]=4 413 B19R2.8977 CCCCSc1ccccc1Oc2ccccc2 62a_100000210211_100000049502 [2,0,0,0,0,0|1,1,0]=4 414 B19R2.8977 CCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000210303 [2,0,0,0,0,0|2,0,0]=4 415 B19R2.8977 CCCSCc1ccccc1Oc2ccccc2 62a_100000210303_100000199117 [2,0,0,0,0,0|2,0,0]=4 416 B19R2.8977 CCCSCc1ccccc1Sc2ccccc2 62a_100000719477_200000173363 [2,0,0,0,0,0|2,0,0]=4 417 B19R2.8977 CCCSCc1ccccc1Sc2ccccc2 62a_200000173363_100000041952 [2,0,0,0,0,0|2,0,0]=4 418 B21R2.1935 CCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000210326 [1,1,0,0,0,0|1,0,0]=3 419 B21R2.1935 CCCCCC(=O)c1ccccc1Oc2ccccc2 1458a_100000185727_100000210326 [1,1,0,0,0,0|2,0,0]=4 420 B21R2.1935 CCCCCC(=O)c1ccccc1Sc2ccccc2 1458a_100000187566_100000210326 [1,1,0,0,0,0|2,0,0]=4 421 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)Cl 2230a_100000185534_100000210326 [1,1,0,0,0,0|2,0,0]=4 422 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)Cl 34a_100000185534_100000718602 [1,1,0,0,0,0|2,0,0]=4 423 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)Cl 7a_100000185534_100000210326 [1,1,0,0,0,0|2,0,0]=4 424 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)F 2230a_100000750978_100000210326 [1,1,0,0,0,0|2,0,0]=4 425 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)F 34a_100000750978_100000718602 [1,1,0,0,0,0|2,0,0]=4 426 B21R2.7254 CCCCCNc1cc(ccc1Oc2ccccc2)F 7a_100000750978_100000210326 [1,1,0,0,0,0|2,0,0]=4 427 B21R2.7570 CCCCCSc1ccccc1C(=O)c2ccccc2 62a_100000198044_100000210326 [1,1,0,0,0,0|0,1,1]=4 428 B21R2.7570 CCCCCSc1ccccc1C(N)c2ccccc2 62a_100000210326_100011211563 [1,1,0,0,0,0|0,1,0]=3 429 B21R2.7570 CCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000210326 [1,1,0,0,0,0|0,1,0]=3 430 B21R2.12800 C=C(C)CCSCc1ccccc1Cc2ccccc2 62a_100000730704_100010254464 [1,1,0,0,0,0|2,0,0]=4 431 B21R2.12800 C=C(C)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000730704 [1,1,0,0,0,0|2,0,0]=4 432 B21R2.12800 CC(=CCCOc1ccccc1Cc2ccccc2)C 34a_100000211249_100011217483 [1,1,0,0,0,0|0,0,2]=4 433 B21R2.12800 CC(=CCCOc1ccccc1Cc2ccccc2)C 7a_100000211249_100011217483 [1,1,0,0,0,0|0,0,2]=4 434 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011214892 [1,1,0,0,0,0|1,0,0]=3 435 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011214892 [1,1,0,0,0,0|1,0,0]=3 436 B21R2.12800 CC(C)CCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011214892 [1,1,0,0,0,0|1,0,0]=3 437 B21R2.12800 CC(C)CCCNc1ccccc1Oc2ccccc2 2230a_100000182328_100011214892 [1,1,0,0,0,0|2,0,0]=4 438 B21R2.12800 CC(C)CCCNc1ccccc1Oc2ccccc2 34a_100000182328_100011214892 [1,1,0,0,0,0|2,0,0]=4 439 B21R2.12800 CC(C)CCCNc1ccccc1Sc2ccccc2 2230a_100000210917_100011214892 [1,1,0,0,0,0|2,0,0]=4 440 B21R2.12800 CC(C)CCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011214892 [1,1,0,0,0,0|0,0,0]=2 441 B21R2.12800 CC(C)CCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011214892 [1,1,0,0,0,0|0,0,0]=2 442 B21R2.12800 CC(C)CCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011214892 [1,1,0,0,0,0|1,0,0]=3 443 B21R2.12800 CC(C)CCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011214892 [1,1,0,0,0,0|1,0,0]=3 444 B21R2.12800 CC(C)CCCSc1ccccc1Cc2ccccc2 62a_100011214892_200011216382 [1,1,0,0,0,0|0,1,0]=3 445 B21R2.12800 CC(C)CCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011214892 [1,1,0,0,0,0|0,1,0]=3 446 B21R2.12800 CC(C)CCCSc1ccccc1Nc2ccccc2 62a_100011214892_100009815782 [1,1,0,0,0,0|1,1,0]=4 447 B21R2.12800 CC(C)CCSCc1ccccc1Cc2ccccc2 62a_100000210312_100010254464 [1,1,0,0,0,0|2,0,0]=4 448 B21R2.12800 CC(C)CCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000210312 [1,1,0,0,0,0|2,0,0]=4 449 B21R2.12800 CC(C)SCCOc1ccccc1Oc2ccccc2 34a_100000074787_100000730970 [1,1,0,0,0,0|2,0,0]=4 450 B21R2.12800 CC(C)SCCOc1ccccc1Oc2ccccc2 7a_100000074787_100000730970 [1,1,0,0,0,0|2,0,0]=4 451 B21R2.12800 CC(C)SCCSc1ccccc1Cc2ccccc2 62a_100000730970_200011216382 [1,1,0,0,0,0|1,1,0]=4 452 B21R2.12800 CC(C)SCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000730970 [1,1,0,0,0,0|1,1,0]=4 453 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)C 2230a_100000184146_100000210326 [1,1,0,0,0,0|2,0,0]=4 454 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)C 34a_100000184146_100000718602 [1,1,0,0,0,0|2,0,0]=4 455 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)C 7a_100000184146_100000210326 [1,1,0,0,0,0|2,0,0]=4 456 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)F 2230a_100000743720_100000210326 [1,1,0,0,0,0|2,0,0]=4 457 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)F 34a_100000743720_100000718602 [1,1,0,0,0,0|2,0,0]=4 458 B21R2.14086 CCCCCNc1ccccc1Oc2cccc(c2)F 7a_100000743720_100000210326 [1,1,0,0,0,0|2,0,0]=4 459 B21R2.16951 CCCC(C)CNc1ccccc1Cc2ccccc2 2230a_100000211252_100011216630 [1,1,0,0,0,0|1,0,0]=3 460 B21R2.16951 CCCC(C)CNc1ccccc1Cc2ccccc2 34a_100000211252_100011216630 [1,1,0,0,0,0|1,0,0]=3 461 B21R2.16951 CCCC(C)CNc1ccccc1Cc2ccccc2 7a_100000211252_100011216630 [1,1,0,0,0,0|1,0,0]=3 462 B21R2.16951 CCCC(C)CNc1ccccc1Oc2ccccc2 2230a_100000182328_100011216630 [1,1,0,0,0,0|2,0,0]=4 463 B21R2.16951 CCCC(C)CNc1ccccc1Oc2ccccc2 34a_100000182328_100011216630 [1,1,0,0,0,0|2,0,0]=4 464 B21R2.16951 CCCC(C)CNc1ccccc1Sc2ccccc2 2230a_100000210917_100011216630 [1,1,0,0,0,0|2,0,0]=4 465 B21R2.16951 CCCC(C)COc1ccccc1Cc2ccccc2 34a_100000211249_100011216630 [1,1,0,0,0,0|0,0,0]=2 466 B21R2.16951 CCCC(C)COc1ccccc1Cc2ccccc2 7a_100000211249_100011216630 [1,1,0,0,0,0|0,0,0]=2 467 B21R2.16951 CCCC(C)COc1ccccc1Oc2ccccc2 34a_100000074787_100011216630 [1,1,0,0,0,0|1,0,0]=3 468 B21R2.16951 CCCC(C)COc1ccccc1Oc2ccccc2 7a_100000074787_100011216630 [1,1,0,0,0,0|1,0,0]=3 469 B21R2.16951 CCCC(C)CSc1ccccc1Cc2ccccc2 62a_100011216630_200011216382 [1,1,0,0,0,0|0,1,0]=3 470 B21R2.16951 CCCC(C)CSc1ccccc1Cc2ccccc2 62a_200011216382_100011216630 [1,1,0,0,0,0|0,1,0]=3 471 B21R2.16951 CCCC(C)CSc1ccccc1Nc2ccccc2 62a_100011216630_100009815782 [1,1,0,0,0,0|1,1,0]=4 472 B21R2.16951 CCCC(C)SCc1ccccc1Cc2ccccc2 62a_100000766640_100010254464 [1,1,0,0,0,0|2,0,0]=4 473 B21R2.16951 CCCC(C)SCc1ccccc1Cc2ccccc2 62a_100010254464_100000766640 [1,1,0,0,0,0|2,0,0]=4 474 B21R2.21331 CCCCCNc1ccccc1Oc2ccc(cc2)C 34a_100025771381_100000718602 [1,1,0,0,0,0|2,0,0]=4 475 B21R2.21331 CCCCCNc1ccccc1Oc2ccc(cc2)Cl 2230a_100000745279_100000210326 [1,1,0,0,0,0|2,0,0]=4 476 B21R2.21331 CCCCCNc1ccccc1Oc2ccc(cc2)Cl 34a_100000745279_100000718602 [1,1,0,0,0,0|2,0,0]=4 477 B21R2.21331 CCCCCNc1ccccc1Oc2ccc(cc2)F 2230a_100011202611_100000210326 [1,1,0,0,0,0|2,0,0]=4 478 B21R2.21331 CCCCCNc1ccccc1Oc2ccc(cc2)F 34a_100011202611_100000718602 [1,1,0,0,0,0|2,0,0]=4 479 B21R2.21331 CCCCCNc1ccccc1Sc2ccc(cc2)F 34a_100011228964_100000718602 [1,1,0,0,0,0|2,0,0]=4 480 B21R2.21331 CCCCCSc1ccccc1Oc2ccc(cc2)F 62a_100000210326_200010782033 [1,1,0,0,0,0|1,1,0]=4 481 B21R2.21331 CCCCCSc1ccccc1Oc2ccc(cc2)F 62a_200010782033_100000210326 [1,1,0,0,0,0|1,1,0]=4 482 B21R2.21690 C=CCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000757094 [1,1,0,0,0,0|0,0,2]=4 483 B21R2.21690 C=CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000757094 [1,1,0,0,0,0|0,0,2]=4 484 B21R2.21690 CC/C=C\COc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100103147603 [1,1,0,0,0,0|0,0,2]=4 485 B21R2.21690 CC/C=C\COc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100103147603 [1,1,0,0,0,0|0,0,2]=4 486 B21R2.21690 CCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000718602 [1,1,0,0,0,0|0,0,0]=2 487 B21R2.21690 CCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000210326 [1,1,0,0,0,0|0,0,0]=2 488 B21R2.21690 CCSCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000757381 [1,1,0,0,0,0|1,0,0]=3 489 B21R2.21690 CCSCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000757381 [1,1,0,0,0,0|1,0,0]=3 490 B21R2.21690 FCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000729493 [1,1,0,0,0,0|1,0,0]=3 491 B21R2.21690 FCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000729493 [1,1,0,0,0,0|1,0,0]=3 492 B21R2.23057 CCC(C)CSCc1ccccc1Cc2ccccc2 62a_100000748023_100010254464 [1,1,0,0,0,0|2,0,0]=4 493 B21R2.23057 CCC(C)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100000748023 [1,1,0,0,0,0|2,0,0]=4 494 B21R2.23057 CC[C@H](C)CSCc1ccccc1Cc2ccccc2 62a_100009816398_100010254464 [1,1,0,0,0,0|2,0,0]=4 495 B21R2.23057 CC[C@H](C)CSCc1ccccc1Cc2ccccc2 62a_100010254464_100009816398 [1,1,0,0,0,0|2,0,0]=4 496 B21R2.25774 CCCCC(C)Nc1ccccc1Cc2ccccc2 2230a_100000211252_200011215066 [1,1,0,0,0,0|1,0,0]=3 497 B21R2.25774 CCCCC(C)Nc1ccccc1Cc2ccccc2 34a_100000211252_200011215066 [1,1,0,0,0,0|1,0,0]=3 498 B21R2.25774 CCCCC(C)Nc1ccccc1Cc2ccccc2 7a_100000211252_200011215066 [1,1,0,0,0,0|1,0,0]=3 499 B21R2.25774 CCCCC(C)Nc1ccccc1Oc2ccccc2 2230a_100000182328_200011215066 [1,1,0,0,0,0|2,0,0]=4 500 B21R2.25774 CCCCC(C)Nc1ccccc1Oc2ccccc2 34a_100000182328_200011215066 [1,1,0,0,0,0|2,0,0]=4 501 B21R2.25774 CCCCC(C)Nc1ccccc1Sc2ccccc2 2230a_100000210917_200011215066 [1,1,0,0,0,0|2,0,0]=4 502 B21R2.25774 CCCCC(C)Oc1ccccc1Cc2ccccc2 34a_100000211249_200011215066 [1,1,0,0,0,0|0,0,0]=2 503 B21R2.25774 CCCCC(C)Oc1ccccc1Cc2ccccc2 7a_100000211249_200011215066 [1,1,0,0,0,0|0,0,0]=2 504 B21R2.25774 CCCCC(C)Oc1ccccc1Oc2ccccc2 34a_100000074787_200011215066 [1,1,0,0,0,0|1,0,0]=3 505 B21R2.25774 CCCCC(C)Oc1ccccc1Oc2ccccc2 7a_100000074787_200011215066 [1,1,0,0,0,0|1,0,0]=3 506 B21R2.25774 CCCCC(C)Sc1ccccc1Cc2ccccc2 62a_200011215066_200011216382 [1,1,0,0,0,0|0,1,0]=3 507 B21R2.25774 CCCCC(C)Sc1ccccc1Cc2ccccc2 62a_200011216382_200011215066 [1,1,0,0,0,0|0,1,0]=3 508 B21R2.273552 CCCCCNc1ccccc1Oc2ccccc2C 2230a_100000188859_100000210326 [1,1,0,0,0,0|2,0,0]=4 509 B21R2.273552 CCCCCNc1ccccc1Oc2ccccc2C 34a_100000188859_100000718602 [1,1,0,0,0,0|2,0,0]=4 510 B21R2.273552 CCCCCNc1ccccc1Oc2ccccc2C 7a_100000188859_100000210326 [1,1,0,0,0,0|2,0,0]=4 511 B21R2.2584 CCCCCCNc1cc(ccc1c2ccccc2)C 34a_100012281694_100000210314 [0,1,0,0,1,0|2,0,0]=4 512 B21R2.2584 CCCCCCNc1cc(ccc1c2ccccc2)C 7a_100012281694_100000210314 [0,1,0,0,1,0|2,0,0]=4 513 B21R2.2596 CCCCCCNc1ccccc1c2ccc(cc2)C 34a_200020605178_100000210314 [0,1,0,0,1,0|2,0,0]=4 514 B21R2.2596 CCCCCCNc1ccccc1c2ccc(cc2)F 34a_100011217704_100000210314 [0,1,0,0,1,0|2,0,0]=4 515 B21R2.2888 CCCCCCC(=O)c1ccccc1c2ccccc2 1458a_100000211553_100000210757 [0,1,0,0,1,0|2,0,0]=4 516 B21R2.2888 CCCCCCN(C)c1ccccc1c2ccccc2 2230a_100000745565_100000210314 [0,1,0,0,1,0|2,0,0]=4 517 B21R2.2888 CCCCCCN(C)c1ccccc1c2ccccc2 269982a_100000745565_100000210757 [0,1,0,0,1,0|2,0,0]=4 518 B21R2.2888 CCCCCCN(C)c1ccccc1c2ccccc2 34a_100000745565_100000210314 [0,1,0,0,1,0|2,0,0]=4 519 B21R2.4286 BrCCCCCOCc1ccccc1c2ccccc2 34a_100000746331_100009813379 [0,1,0,0,1,0|2,0,0]=4 520 B21R2.4286 BrCCCCCOCc1ccccc1c2ccccc2 7a_100000746331_100009813379 [0,1,0,0,1,0|2,0,0]=4 521 B21R2.4286 C=CCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100000700193 [0,1,0,0,1,0|1,0,1]=4 522 B21R2.4286 C=CCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100000700193 [0,1,0,0,1,0|1,0,1]=4 523 B21R2.4286 C=CCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100011215482 [0,1,0,0,1,0|1,0,1]=4 524 B21R2.4286 C=CCCCCOCc1ccccc1c2ccccc2 34a_100000766645_100009813379 [0,1,0,0,1,0|1,0,1]=4 525 B21R2.4286 C=CCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100011215482 [0,1,0,0,1,0|1,0,1]=4 526 B21R2.4286 C=CCCCCOCc1ccccc1c2ccccc2 7a_100000766645_100009813379 [0,1,0,0,1,0|1,0,1]=4 527 B21R2.4286 CC=CCCCOCc1ccccc1c2ccccc2 34a_100020645299_100009813379 [0,1,0,0,1,0|1,0,1]=4 528 B21R2.4286 CCCCCCCNc1ccccc1c2ccccc2 34a_100000210918_100000210614 [0,1,0,0,1,0|2,0,0]=4 529 B21R2.4286 CCCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100000210614 [0,1,0,0,1,0|1,0,0]=3 530 B21R2.4286 CCCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100000210614 [0,1,0,0,1,0|1,0,0]=3 531 B21R2.4286 CCCCCCCOc1ccccc1c2ccccn2 34a_100012186605_100000210614 [0,1,0,0,1,0|2,0,0]=4 532 B21R2.4286 CCCCCCCOc1ccccc1c2ccccn2 7a_100012186605_100000210614 [0,1,0,0,1,0|2,0,0]=4 533 B21R2.4286 CCCCCCCOc1cccnc1c2ccccc2 34a_100011996219_100000210614 [0,1,0,0,1,0|2,0,0]=4 534 B21R2.4286 CCCCCCCOc1cccnc1c2ccccc2 7a_100011996219_100000210614 [0,1,0,0,1,0|2,0,0]=4 535 B21R2.4286 CCCCCCNCc1ccccc1c2ccccc2 207a_100000210581_100011219292 [0,1,0,0,1,0|2,0,0]=4 536 B21R2.4286 CCCCCCNCc1ccccc1c2ccccc2 2230a_100000210581_100009813379 [0,1,0,0,1,0|2,0,0]=4 537 B21R2.4286 CCCCCCNCc1ccccc1c2ccccc2 270004a_100000210581_100011219292 [0,1,0,0,1,0|2,0,0]=4 538 B21R2.4286 CCCCCCNCc1ccccc1c2ccccc2 34a_100000071662_100000210314 [0,1,0,0,1,0|2,0,0]=4 539 B21R2.4286 CCCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100000210314 [0,1,0,0,1,0|1,0,0]=3 540 B21R2.4286 CCCCCCOCc1ccccc1c2ccccc2 34a_100000210259_100009813379 [0,1,0,0,1,0|1,0,0]=3 541 B21R2.4286 CCCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000210314 [0,1,0,0,1,0|1,0,0]=3 542 B21R2.4286 CCCCCCOCc1ccccc1c2ccccc2 7a_100000210259_100009813379 [0,1,0,0,1,0|1,0,0]=3 543 B21R2.4286 CCCCOCCSc1ccccc1c2ccccc2 62a_100000033479_100000743108 [0,1,0,0,1,0|1,1,0]=4 544 B21R2.4286 CCCCOCCSc1ccccc1c2ccccc2 62a_100000743108_100000033479 [0,1,0,0,1,0|1,1,0]=4 545 B21R2.4286 CCCSCCOCc1ccccc1c2ccccc2 34a_200000230433_100009813379 [0,1,0,0,1,0|2,0,0]=4 546 B21R2.4286 CCCSCCOCc1ccccc1c2ccccc2 7a_200000230433_100009813379 [0,1,0,0,1,0|2,0,0]=4 547 B21R2.4286 CCSCCCOCc1ccccc1c2ccccc2 34a_100011216438_100009813379 [0,1,0,0,1,0|2,0,0]=4 548 B21R2.4286 CCSCCCOCc1ccccc1c2ccccc2 7a_100011216438_100009813379 [0,1,0,0,1,0|2,0,0]=4 549 B21R2.4286 COCCCCSCc1ccccc1c2ccccc2 62a_100000730899_100009813379 [0,1,0,0,1,0|1,1,0]=4 550 B21R2.4286 COCCCCSCc1ccccc1c2ccccc2 62a_100009813379_100000730899 [0,1,0,0,1,0|1,1,0]=4 551 B21R2.4286 CSCCCCOCc1ccccc1c2ccccc2 34a_100011217163_100009813379 [0,1,0,0,1,0|1,0,0]=3 552 B21R2.4286 CSCCCCOCc1ccccc1c2ccccc2 7a_100011217163_100009813379 [0,1,0,0,1,0|1,0,0]=3 553 B21R2.4286 ClCCCCCOCc1ccccc1c2ccccc2 34a_100000746330_100009813379 [0,1,0,0,1,0|2,0,0]=4 554 B21R2.4286 ClCCCCCOCc1ccccc1c2ccccc2 7a_100000746330_100009813379 [0,1,0,0,1,0|2,0,0]=4 555 B21R2.4286 FCCCCCCNc1ccccc1c2ccccc2 34a_100000210918_100015922095 [0,1,0,0,1,0|2,0,0]=4 556 B21R2.4286 FCCCCCCOc1ccccc1c2ccccc2 34a_100000210297_100015922095 [0,1,0,0,1,0|1,0,0]=3 557 B21R2.4286 FCCCCCCOc1ccccc1c2ccccc2 7a_100000210297_100015922095 [0,1,0,0,1,0|1,0,0]=3 558 B21R2.4286 FCCCCCCSc1ccccc1c2ccccc2 62a_100000033479_100015922095 [0,1,0,0,1,0|1,1,0]=4 559 B21R2.4286 FCCCCCCSc1ccccc1c2ccccc2 62a_100015922095_100000033479 [0,1,0,0,1,0|1,1,0]=4 560 B21R2.4286 FCCCCCOCc1ccccc1c2ccccc2 34a_100000032370_100000729378 [0,1,0,0,1,0|2,0,0]=4 561 B21R2.4286 FCCCCCOCc1ccccc1c2ccccc2 7a_100000032370_100000729378 [0,1,0,0,1,0|2,0,0]=4 562 B21R2.4286 ICCCCCOCc1ccccc1c2ccccc2 34a_200012148887_100009813379 [0,1,0,0,1,0|2,0,0]=4 563 B21R2.4286 ICCCCCOCc1ccccc1c2ccccc2 7a_200012148887_100009813379 [0,1,0,0,1,0|2,0,0]=4 564 B21R2.4286 OCCCCCCSc1ccccc1c2ccccc2 62a_100000033479_100000766143 [0,1,0,0,1,0|1,1,0]=4 565 B21R2.4286 OCCCCCCSc1ccccc1c2ccccc2 62a_100000766143_100000033479 [0,1,0,0,1,0|1,1,0]=4 566 B21R2.4833 CCCCCC(C)Nc1ccccc1c2ccccc2 34a_100000210918_200011218191 [0,1,0,0,1,0|2,0,0]=4 567 B21R2.4833 CCCCCC(C)Oc1ccccc1c2ccccc2 34a_100000210297_200011218191 [0,1,0,0,1,0|1,0,0]=3 568 B21R2.4833 CCCCCC(C)Oc1ccccc1c2ccccc2 7a_100000210297_200011218191 [0,1,0,0,1,0|1,0,0]=3 569 B21R2.4833 CCCCCC(C)Oc1ccccc1c2ccccn2 34a_100012186605_200011218191 [0,1,0,0,1,0|2,0,0]=4 570 B21R2.4833 CCCCCC(C)Oc1ccccc1c2ccccn2 7a_100012186605_200011218191 [0,1,0,0,1,0|2,0,0]=4 571 B21R2.4833 CCCCCC(C)Oc1cccnc1c2ccccc2 34a_100011996219_200011218191 [0,1,0,0,1,0|2,0,0]=4 572 B21R2.4833 CCCCCC(C)Oc1cccnc1c2ccccc2 7a_100011996219_200011218191 [0,1,0,0,1,0|2,0,0]=4 573 B21R2.12957 CC(=O)CCCCSc1ccccc1c2ccccc2 62a_100000033479_100000735457 [0,1,0,0,1,0|1,1,0]=4 574 B21R2.12957 CC(=O)CCCCSc1ccccc1c2ccccc2 62a_100000735457_100000033479 [0,1,0,0,1,0|1,1,0]=4 575 B21R2.12957 CC(C)CCCCNc1ccccc1c2ccccc2 34a_100000210918_100011216152 [0,1,0,0,1,0|2,0,0]=4 576 B21R2.12957 CC(C)CCCCOc1ccccc1c2ccccc2 34a_100000210297_100011216152 [0,1,0,0,1,0|1,0,0]=3 577 B21R2.12957 CC(C)CCCCOc1ccccc1c2ccccc2 7a_100000210297_100011216152 [0,1,0,0,1,0|1,0,0]=3 578 B21R2.24296 CCCCCCNc1ccccc1c2cccc(c2)C 2230a_100020605107_100000210314 [0,1,0,0,1,0|2,0,0]=4 579 B21R2.24296 CCCCCCNc1ccccc1c2cccc(c2)C 34a_100020605107_100000210314 [0,1,0,0,1,0|2,0,0]=4 580 B21R2.24296 CCCCCCNc1ccccc1c2cccc(c2)C 7a_100020605107_100000210314 [0,1,0,0,1,0|2,0,0]=4 581 B21R2.24594 C#CCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100010269958 [0,1,0,0,1,0|1,0,1]=4 582 B21R2.24594 C#CCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100010269958 [0,1,0,0,1,0|1,0,1]=4 583 B21R2.24594 C=CCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100011215482 [0,1,0,0,1,0|1,0,1]=4 584 B21R2.24594 C=CCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100011215482 [0,1,0,0,1,0|1,0,1]=4 585 B21R2.24594 CCCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100000210314 [0,1,0,0,1,0|1,0,0]=3 586 B21R2.24594 CCCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000210314 [0,1,0,0,1,0|1,0,0]=3 587 B21R2.24594 CCCCCCSc1ccc(cc1c2ccccc2)N 62a_200010239565_100000210757 [0,1,0,0,1,0|1,1,0]=4 588 B21R2.24594 CCCCOCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100011995733 [0,1,0,0,1,0|2,0,0]=4 589 B21R2.24594 FCCCCCOc1ccc(cc1c2ccccc2)I 34a_100000728419_100000729378 [0,1,0,0,1,0|2,0,0]=4 590 B21R2.24594 FCCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000729378 [0,1,0,0,1,0|2,0,0]=4 591 B21R2.24594 N#CCCCCOc1ccc(cc1c2ccccc2)I 7a_100000728419_100000211819 [0,1,0,0,1,0|2,0,0]=4 592 B21R2.46828 C#CCCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100010269958 [0,1,0,0,1,0|1,0,1]=4 593 B21R2.46828 C#CCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100010269958 [0,1,0,0,1,0|1,0,1]=4 594 B21R2.46828 C=CCCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100011215482 [0,1,0,0,1,0|1,0,1]=4 595 B21R2.46828 C=CCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100011215482 [0,1,0,0,1,0|1,0,1]=4 596 B21R2.46828 C=CCCCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100011215482 [0,1,0,0,1,0|1,0,1]=4 597 B21R2.46828 C=CCCCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100011215482 [0,1,0,0,1,0|1,0,1]=4 598 B21R2.46828 CCCCCCOc1c(cccc1c2ccccc2)C 34a_100000060226_100000210314 [0,1,0,0,1,0|1,0,0]=3 599 B21R2.46828 CCCCCCOc1c(cccc1c2ccccc2)C 7a_100000060226_100000210314 [0,1,0,0,1,0|1,0,0]=3 600 B21R2.46828 CCCCOCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100011995733 [0,1,0,0,1,0|2,0,0]=4 601 B21R2.46828 Cc1cccc(c1OCCCCCF)c2ccccc2 34a_100000060226_100000729378 [0,1,0,0,1,0|2,0,0]=4 602 B21R2.46828 Cc1cccc(c1OCCCCCF)c2ccccc2 7a_100000060226_100000729378 [0,1,0,0,1,0|2,0,0]=4 603 B21R2.46828 FCCCCCOc1c(cccc1c2ccccc2)Br 34a_200034179028_100000729378 [0,1,0,0,1,0|2,0,0]=4 604 B21R2.46828 FCCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100000729378 [0,1,0,0,1,0|2,0,0]=4 605 B21R2.46828 N#CCCCCOc1c(cccc1c2ccccc2)Br 7a_200034179028_100000211819 [0,1,0,0,1,0|2,0,0]=4 606 B21R2.470948 C=CCCCCOc1ccccc1c2ccccc2C 34a_200011997984_100011215482 [0,1,0,0,1,0|1,0,1]=4 607 B21R2.470948 C=CCCCCOc1ccccc1c2ccccc2C 7a_200011997984_100011215482 [0,1,0,0,1,0|1,0,1]=4 608 B21R2.470948 CCCCCCNc1ccccc1c2ccccc2C 34a_100020605195_100000210314 [0,1,0,0,1,0|2,0,0]=4 609 B21R2.470948 CCCCCCOc1ccccc1c2ccccc2C 34a_200011997984_100000210314 [0,1,0,0,1,0|1,0,0]=3 610 B21R2.470948 CCCCCCOc1ccccc1c2ccccc2C 7a_200011997984_100000210314 [0,1,0,0,1,0|1,0,0]=3 611 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCCF 34a_200011997984_100000729378 [0,1,0,0,1,0|2,0,0]=4 612 B21R2.470948 Cc1ccccc1c2ccccc2OCCCCCF 7a_200011997984_100000729378 [0,1,0,0,1,0|2,0,0]=4 613 B23R2.29036 C#CCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100010269958 [0,1,0,0,0,1|1,0,1]=4 614 B23R2.29036 C#CCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100010269958 [0,1,0,0,0,1|1,0,1]=4 615 B23R2.29036 C=CCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100011215482 [0,1,0,0,0,1|1,0,1]=4 616 B23R2.29036 C=CCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100011215482 [0,1,0,0,0,1|1,0,1]=4 617 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)C 207a_100000124888_200000189357 [0,1,0,0,0,1|1,0,0]=3 618 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)C 270302a_100000124888_200000189357 [0,1,0,0,0,1|1,0,0]=3 619 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)Cl 207a_100000210052_200000189357 [0,1,0,0,0,1|1,0,0]=3 620 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)Cl 270302a_100000210052_200000189357 [0,1,0,0,0,1|1,0,0]=3 621 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)F 207a_100000185862_200000189357 [0,1,0,0,0,1|1,0,0]=3 622 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)F 270302a_100000185862_200000189357 [0,1,0,0,0,1|1,0,0]=3 623 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)I 207a_100000185761_200000189357 [0,1,0,0,0,1|1,0,0]=3 624 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)I 270302a_100000185761_200000189357 [0,1,0,0,0,1|1,0,0]=3 625 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100000210314 [0,1,0,0,0,1|1,0,0]=3 626 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000210314 [0,1,0,0,0,1|1,0,0]=3 627 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cn2)Cl 34a_200005835295_100000210314 [0,1,0,0,0,1|2,0,0]=4 628 B23R2.29036 CCCCCCOc1ccccc1CNc2ccc(cn2)Cl 7a_200005835295_100000210314 [0,1,0,0,0,1|2,0,0]=4 629 B23R2.29036 CCCCOCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100011995733 [0,1,0,0,0,1|2,0,0]=4 630 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)C 34a_200015186568_100000755781 [0,1,0,0,0,1|2,0,0]=4 631 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)C 7a_200015186568_100000730899 [0,1,0,0,0,1|2,0,0]=4 632 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)Cl 2230a_100000299865_100000730899 [0,1,0,0,0,1|2,0,0]=4 633 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)Cl 34a_100000299865_100000755781 [0,1,0,0,0,1|2,0,0]=4 634 B23R2.29036 COCCCCNc1ccccc1SCc2ccc(cc2)Cl 7a_100000299865_100000730899 [0,1,0,0,0,1|2,0,0]=4 635 B23R2.29036 FCCCCCOc1ccccc1CNc2ccc(cc2)I 34a_200000313668_100000729378 [0,1,0,0,0,1|2,0,0]=4 636 B23R2.29036 FCCCCCOc1ccccc1CNc2ccc(cc2)I 7a_200000313668_100000729378 [0,1,0,0,0,1|2,0,0]=4 637 B23R2.31771 C#CCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100010269958 [0,1,0,0,0,1|1,0,1]=4 638 B23R2.31771 C#CCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100010269958 [0,1,0,0,0,1|1,0,1]=4 639 B23R2.31771 C=CCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100011215482 [0,1,0,0,0,1|1,0,1]=4 640 B23R2.31771 C=CCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100011215482 [0,1,0,0,0,1|1,0,1]=4 641 B23R2.31771 CCCCCCNc1ccc(cc1OCc2ccccc2)C 2230a_100011220564_100000210314 [0,1,0,0,0,1|2,0,0]=4 642 B23R2.31771 CCCCCCNc1ccc(cc1OCc2ccccc2)C 34a_100011220564_100000210314 [0,1,0,0,0,1|2,0,0]=4 643 B23R2.31771 CCCCCCNc1ccc(cc1OCc2ccccc2)F 2230a_100011195462_100000210314 [0,1,0,0,0,1|2,0,0]=4 644 B23R2.31771 CCCCCCNc1ccc(cc1OCc2ccccc2)F 34a_100011195462_100000210314 [0,1,0,0,0,1|2,0,0]=4 645 B23R2.31771 CCCCCCNc1ccc(cc1OCc2ccccc2)F 7a_100011195462_100000210314 [0,1,0,0,0,1|2,0,0]=4 646 B23R2.31771 CCCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100000210314 [0,1,0,0,0,1|1,0,0]=3 647 B23R2.31771 CCCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000210314 [0,1,0,0,0,1|1,0,0]=3 648 B23R2.31771 CCCCOCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100011995733 [0,1,0,0,0,1|2,0,0]=4 649 B23R2.31771 COCCCCOc1ccc(cc1N=Nc2ccccc2)C 34a_200000009075_100000755781 [0,1,0,0,0,1|2,0,0]=4 650 B23R2.31771 COCCCCOc1ccc(cc1N=Nc2ccccc2)C 7a_200000009075_100000730899 [0,1,0,0,0,1|2,0,0]=4 651 B23R2.31771 FCCCCCOc1ccc(cc1OCc2ccccc2)Br 34a_100010157380_100000729378 [0,1,0,0,0,1|2,0,0]=4 652 B23R2.31771 FCCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000729378 [0,1,0,0,0,1|2,0,0]=4 653 B23R2.31771 N#CCCCCOc1ccc(cc1OCc2ccccc2)Br 7a_100010157380_100000211819 [0,1,0,0,0,1|2,0,0]=4 654 B23R2.32080 C=CCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000700193 [0,1,0,0,0,1|1,0,1]=4 655 B23R2.32080 C=CCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000700193 [0,1,0,0,0,1|1,0,1]=4 656 B23R2.32080 C=CCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100011215482 [0,1,0,0,0,1|1,0,1]=4 657 B23R2.32080 C=CCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100011215482 [0,1,0,0,0,1|1,0,1]=4 658 B23R2.32080 C=CCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100011215482 [0,1,0,0,0,1|1,0,1]=4 659 B23R2.32080 C=CCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100011215482 [0,1,0,0,0,1|1,0,1]=4 660 B23R2.32080 CCCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100000210681 [0,1,0,0,0,1|2,0,0]=4 661 B23R2.32080 CCCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100000210614 [0,1,0,0,0,1|2,0,0]=4 662 B23R2.32080 CCCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100000210614 [0,1,0,0,0,1|2,0,0]=4 663 B23R2.32080 CCCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100000210614 [0,1,0,0,0,1|2,0,0]=4 664 B23R2.32080 CCCCCCCOc1ccccc1CNc2cccnc2 34a_200000712809_100000210614 [0,1,0,0,0,1|2,0,0]=4 665 B23R2.32080 CCCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100000210614 [0,1,0,0,0,1|1,0,0]=3 666 B23R2.32080 CCCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100000210614 [0,1,0,0,0,1|1,0,0]=3 667 B23R2.32080 CCCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000210314 [0,1,0,0,0,1|1,0,0]=3 668 B23R2.32080 CCCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000210314 [0,1,0,0,0,1|1,0,0]=3 669 B23R2.32080 CCCCCCOCc1ccccc1OCc2ccccc2 34a_100000187657_100000210314 [0,1,0,0,0,1|1,0,0]=3 670 B23R2.32080 CCCCCCOCc1ccccc1OCc2ccccc2 7a_100000187657_100000210314 [0,1,0,0,0,1|1,0,0]=3 671 B23R2.32080 CCCCCOCCc1ccccc1OCc2ccccc2 34a_100000721452_100000718602 [0,1,0,0,0,1|2,0,0]=4 672 B23R2.32080 CCCCCOCCc1ccccc1OCc2ccccc2 7a_100000721452_100000210326 [0,1,0,0,0,1|2,0,0]=4 673 B23R2.32080 CCCCOCCNc1ccccc1SCc2ccccc2 34a_100000198535_100000743108 [0,1,0,0,0,1|2,0,0]=4 674 B23R2.32080 CCCCOCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000743108 [0,1,0,0,0,1|2,0,0]=4 675 B23R2.32080 CCCCOCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000743108 [0,1,0,0,0,1|1,1,0]=4 676 B23R2.32080 CCCCOCCSc1ccccc1OCc2ccccc2 62a_100000743108_100000151716 [0,1,0,0,0,1|1,1,0]=4 677 B23R2.32080 FCCCCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100015922095 [0,1,0,0,0,1|2,0,0]=4 678 B23R2.32080 FCCCCCCNc1ccccc1COc2ccccc2 34a_100000742786_100015922095 [0,1,0,0,0,1|2,0,0]=4 679 B23R2.32080 FCCCCCCNc1ccccc1COc2ccccc2 7a_100000742786_100015922095 [0,1,0,0,0,1|2,0,0]=4 680 B23R2.32080 FCCCCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100015922095 [0,1,0,0,0,1|2,0,0]=4 681 B23R2.32080 FCCCCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100015922095 [0,1,0,0,0,1|2,0,0]=4 682 B23R2.32080 FCCCCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100015922095 [0,1,0,0,0,1|2,0,0]=4 683 B23R2.32080 FCCCCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100015922095 [0,1,0,0,0,1|1,0,0]=3 684 B23R2.32080 FCCCCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100015922095 [0,1,0,0,0,1|1,0,0]=3 685 B23R2.32080 FCCCCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100015922095 [0,1,0,0,0,1|1,1,0]=4 686 B23R2.32080 FCCCCCCSc1ccccc1OCc2ccccc2 62a_100015922095_100000151716 [0,1,0,0,0,1|1,1,0]=4 687 B23R2.32080 FCCCCCOCc1ccccc1CCc2ccccc2 34a_200000042600_100000729378 [0,1,0,0,0,1|2,0,0]=4 688 B23R2.32080 FCCCCCOCc1ccccc1CCc2ccccc2 7a_200000042600_100000729378 [0,1,0,0,0,1|2,0,0]=4 689 B23R2.42324 CCCCCCNc1ccccc1N(C)Cc2ccccc2 2230a_100000745351_100000210314 [0,1,0,0,0,1|2,0,0]=4 690 B23R2.42324 CCCCCCOc1ccccc1C(=O)Cc2ccccc2 7a_100000040333_100000210314 [0,1,0,0,0,1|1,0,0]=3 691 B23R2.62086 CCCCCCC(=O)c1ccccc1CCc2ccccc2 1458a_100000610640_100000210757 [0,1,0,0,0,1|2,0,0]=4 692 B23R2.62086 CCCCCCC(=O)c1ccccc1COc2ccccc2 1458a_100000272412_100000210757 [0,1,0,0,0,1|2,0,0]=4 693 B23R2.62086 CCCCCCC(=O)c1ccccc1OCc2ccccc2 1458a_100000183716_100000210757 [0,1,0,0,0,1|2,0,0]=4 694 B23R2.79607 COCCCCSc1cc(ccc1OCc2ccccc2)C 62a_100000151733_100000730899 [0,1,0,0,0,1|1,1,0]=4 695 B23R2.79607 COCCCCSc1cc(ccc1OCc2ccccc2)C 62a_100000730899_100000151733 [0,1,0,0,0,1|1,1,0]=4 696 B23R2.178532 CCCCCC(C)Nc1ccccc1COc2ccccc2 2230a_100000742786_200011218191 [0,1,0,0,0,1|2,0,0]=4 697 B23R2.178532 CCCCCC(C)Nc1ccccc1COc2ccccc2 34a_100000742786_200011218191 [0,1,0,0,0,1|2,0,0]=4 698 B23R2.178532 CCCCCC(C)Nc1ccccc1COc2ccccc2 7a_100000742786_200011218191 [0,1,0,0,0,1|2,0,0]=4 699 B23R2.178532 CCCCCC(C)Nc1ccccc1OCc2ccccc2 34a_100011193923_200011218191 [0,1,0,0,0,1|2,0,0]=4 700 B23R2.178532 CCCCCC(C)Oc1ccccc1CNc2cccnc2 34a_200000712809_200011218191 [0,1,0,0,0,1|2,0,0]=4 701 B23R2.178532 CCCCCC(C)Oc1ccccc1OCc2ccccc2 34a_100000187230_200011218191 [0,1,0,0,0,1|1,0,0]=3 702 B23R2.178532 CCCCCC(C)Oc1ccccc1OCc2ccccc2 7a_100000187230_200011218191 [0,1,0,0,0,1|1,0,0]=3 703 B23R2.186861 CC(=O)CCCCNc1ccccc1SCc2ccccc2 34a_100000198535_100009817362 [0,1,0,0,0,1|2,0,0]=4 704 B23R2.186861 CC(=O)CCCCNc1ccccc1SCc2ccccc2 7a_100000198535_100000735457 [0,1,0,0,0,1|2,0,0]=4 705 B23R2.186861 CC(=O)CCCCSc1ccccc1OCc2ccccc2 62a_100000151716_100000735457 [0,1,0,0,0,1|1,1,0]=4 706 B23R2.186861 CC(=O)CCCCSc1ccccc1OCc2ccccc2 62a_100000735457_100000151716 [0,1,0,0,0,1|1,1,0]=4 707 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 2230a_100000742786_100011216152 [0,1,0,0,0,1|2,0,0]=4 708 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 34a_100000742786_100011216152 [0,1,0,0,0,1|2,0,0]=4 709 B23R2.186861 CC(C)CCCCNc1ccccc1COc2ccccc2 7a_100000742786_100011216152 [0,1,0,0,0,1|2,0,0]=4 710 B23R2.186861 CC(C)CCCCNc1ccccc1OCc2ccccc2 34a_100011193923_100011216152 [0,1,0,0,0,1|2,0,0]=4 711 B23R2.186861 CC(C)CCCCOc1ccccc1OCc2ccccc2 34a_100000187230_100011216152 [0,1,0,0,0,1|1,0,0]=3 712 B23R2.186861 CC(C)CCCCOc1ccccc1OCc2ccccc2 7a_100000187230_100011216152 [0,1,0,0,0,1|1,0,0]=3 713 B23R2.794954 CCCCCCOc1ccccc1CNc2ccccc2C 207a_100015192222_200000189357 [0,1,0,0,0,1|1,0,0]=3 714 B23R2.794954 CCCCCCOc1ccccc1CNc2ccccc2C 270302a_100015192222_200000189357 [0,1,0,0,0,1|1,0,0]=3 715 B23R2.794954 CCCCCCOc1ccccc1CNc2ccccc2Cl 207a_100000185783_200000189357 [0,1,0,0,0,1|1,0,0]=3 716 B23R2.794954 CCCCCCOc1ccccc1CNc2ccccc2F 207a_100000210422_200000189357 [0,1,0,0,0,1|1,0,0]=3 717 B23R2.794954 CCCCCCOc1ccccc1CNc2ccccc2I 207a_100000210053_200000189357 [0,1,0,0,0,1|1,0,0]=3 718 B23R2.794954 COCCCCNc1ccccc1SCc2ccccc2Cl 2230a_100015185902_100000730899 [0,1,0,0,0,1|2,0,0]=4 719 B23R2.794954 COCCCCNc1ccccc1SCc2ccccc2Cl 34a_100015185902_100000755781 [0,1,0,0,0,1|2,0,0]=4 720 B23R2.794954 COCCCCNc1ccccc1SCc2ccccc2Cl 7a_100015185902_100000730899 [0,1,0,0,0,1|2,0,0]=4 721 B23R2.794954 COCCCCSc1ccccc1OCc2ccccc2C 62a_100000151724_100000730899 [0,1,0,0,0,1|1,1,0]=4 722 B23R2.794954 COCCCCSc1ccccc1OCc2ccccc2C 62a_100000730899_100000151724 [0,1,0,0,0,1|1,1,0]=4 723 B23R2.925149 CCCCCCNc1cccc(c1OCc2ccccc2)F 2230a_100013039107_100000210314 [0,1,0,0,0,1|2,0,0]=4 724 B23R2.925149 CCCCCCNc1cccc(c1OCc2ccccc2)F 34a_100013039107_100000210314 [0,1,0,0,0,1|2,0,0]=4 725 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)C 207a_100000188690_200000189357 [0,1,0,0,0,1|1,0,0]=3 726 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)C 270302a_100000188690_200000189357 [0,1,0,0,0,1|1,0,0]=3 727 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)Cl 207a_100000185859_200000189357 [0,1,0,0,0,1|1,0,0]=3 728 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)Cl 270302a_100000185859_200000189357 [0,1,0,0,0,1|1,0,0]=3 729 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)F 207a_100000210047_200000189357 [0,1,0,0,0,1|1,0,0]=3 730 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)F 270302a_100000210047_200000189357 [0,1,0,0,0,1|1,0,0]=3 731 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)I 207a_100000211102_200000189357 [0,1,0,0,0,1|1,0,0]=3 732 B23R2.925205 CCCCCCOc1ccccc1CNc2cccc(c2)I 270302a_100000211102_200000189357 [0,1,0,0,0,1|1,0,0]=3 733 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)C 2230a_200015184035_100000730899 [0,1,0,0,0,1|2,0,0]=4 734 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)C 34a_200015184035_100000755781 [0,1,0,0,0,1|2,0,0]=4 735 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)C 7a_200015184035_100000730899 [0,1,0,0,0,1|2,0,0]=4 736 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)Cl 2230a_100015184656_100000730899 [0,1,0,0,0,1|2,0,0]=4 737 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)Cl 34a_100015184656_100000755781 [0,1,0,0,0,1|2,0,0]=4 738 B23R2.925205 COCCCCNc1ccccc1SCc2cccc(c2)Cl 7a_100015184656_100000730899 [0,1,0,0,0,1|2,0,0]=4 739 B23R2.62310 CCCCCCC(=O)Cc1ccccc1Cc2ccccc2 1458a_100102632555_100010254464 [0,2,0,0,0,0|2,0,0]=4 740 B23R2.62310 CCCCCCC(=O)Nc1ccccc1Cc2ccccc2 11a_100000211252_100102632555 [0,2,0,0,0,0|2,0,0]=4 741 B23R2.62310 CCCCCCC(=O)Nc1ccccc1Cc2ccccc2 1626a_100000211252_100102632555 [0,2,0,0,0,0|2,0,0]=4 742 B23R2.62310 CCCCCCC(=O)Nc1ccccc1Cc2ccccc2 22a_100000211252_100102632555 [0,2,0,0,0,0|2,0,0]=4 743 B23R2.62310 CCCCCCN(C)Cc1ccccc1Cc2ccccc2 2230a_106256046315_100010254464 [0,2,0,0,0,0|2,0,0]=4 744 B23R2.62310 CCCCCCN(C)Cc1ccccc1Cc2ccccc2 269982a_106256046315_100010254464 [0,2,0,0,0,0|2,0,0]=4 745 B23R2.62310 CCCCCCN(C)Cc1ccccc1Cc2ccccc2 26a_106256046315_100000211249 [0,2,0,0,0,0|2,0,0]=4 746 B23R2.62310 CCCCCCN(C)Cc1ccccc1Cc2ccccc2 270004a_106256046315_100009842342 [0,2,0,0,0,0|2,0,0]=4 747 B23R2.111461 CCCCCC(C)C(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_200011218191 [0,2,0,0,0,0|2,0,0]=4 748 B23R2.178543 CCCCCC(C)Nc1ccccc1C(O)c2ccccc2 2230a_100000246470_200011218191 [0,2,0,0,0,0|2,0,0]=4 749 B23R2.178543 CCCCCC(C)Nc1ccccc1C(O)c2ccccc2 34a_100000246470_200011218191 [0,2,0,0,0,0|2,0,0]=4 750 B23R2.178543 CCCCCC(C)Nc1ccccc1C(O)c2ccccc2 7a_100000246470_200011218191 [0,2,0,0,0,0|2,0,0]=4 751 B23R2.178543 CCCCCC(C)Oc1ccccc1C(=O)c2ccccc2 7a_100011215220_200011218191 [0,2,0,0,0,0|1,0,1]=4 752 B23R2.178543 CCCCCC(C)Sc1ccccc1C(N)c2ccccc2 62a_100011211563_200011218191 [0,2,0,0,0,0|1,1,0]=4 753 B23R2.178543 CCCCCC(C)Sc1ccccc1C(N)c2ccccc2 62a_200011218191_100011211563 [0,2,0,0,0,0|1,1,0]=4 754 B23R2.768 CCCCCC(=O)COc1ccccc1Oc2ccccc2 34a_100000074787_200012276598 [0,2,0,0,0,0|2,0,0]=4 755 B23R2.768 CCCCCC(=O)COc1ccccc1Oc2ccccc2 7a_100000074787_200012276598 [0,2,0,0,0,0|2,0,0]=4 756 B23R2.768 CCCCCC(=O)CSc1ccccc1Cc2ccccc2 62a_200011216382_200012276598 [0,2,0,0,0,0|1,1,0]=4 757 B23R2.768 CCCCCC(=O)CSc1ccccc1Cc2ccccc2 62a_200012276598_200011216382 [0,2,0,0,0,0|1,1,0]=4 758 B23R2.768 CCCCCC(C)NCc1ccccc1Cc2ccccc2 207a_100000211957_100009842342 [0,2,0,0,0,0|2,0,0]=4 759 B23R2.768 CCCCCC(C)NCc1ccccc1Cc2ccccc2 2230a_100000211957_100010254464 [0,2,0,0,0,0|2,0,0]=4 760 B23R2.768 CCCCCC(C)NCc1ccccc1Cc2ccccc2 270004a_100000211957_100009842342 [0,2,0,0,0,0|2,0,0]=4 761 B23R2.768 CCCCCC(C)OCc1ccccc1Cc2ccccc2 34a_100011215632_100010254464 [0,2,0,0,0,0|1,0,0]=3 762 B23R2.768 CCCCCC(C)OCc1ccccc1Cc2ccccc2 7a_100011215632_100010254464 [0,2,0,0,0,0|1,0,0]=3 763 B23R2.768 CCCCCC(C)OCc1ccccc1Oc2ccccc2 34a_100000246416_200011218191 [0,2,0,0,0,0|2,0,0]=4 764 B23R2.768 CCCCCC(C)OCc1ccccc1Oc2ccccc2 7a_100000246416_200011218191 [0,2,0,0,0,0|2,0,0]=4 765 B23R2.768 CCCCCC(C)OCc1ccccc1Oc2ccccc2 7a_100011215632_100000199117 [0,2,0,0,0,0|2,0,0]=4 766 B23R2.9754 C#CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100012094781 [0,2,0,0,0,0|1,0,1]=4 767 B23R2.9754 C#CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100012094781 [0,2,0,0,0,0|1,0,1]=4 768 B23R2.9754 CCCCOCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100000743108 [0,2,0,0,0,0|1,0,0]=3 769 B23R2.9754 CCCCOCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000743108 [0,2,0,0,0,0|1,0,0]=3 770 B23R2.9754 FCCCCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100015922095 [0,2,0,0,0,0|1,0,0]=3 771 B23R2.9754 FCCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100015922095 [0,2,0,0,0,0|1,0,0]=3 772 B23R2.9754 N#CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100009813376 [0,2,0,0,0,0|1,0,1]=4 773 B23R2.9754 O=CCCCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000139337 [0,2,0,0,0,0|1,0,1]=4 774 B23R2.22871 CCCC(C)CCOCc1ccccc1Cc2ccccc2 34a_100011217855_100010254464 [0,2,0,0,0,0|1,0,0]=3 775 B23R2.22871 CCCC(C)CCOCc1ccccc1Cc2ccccc2 7a_100011217855_100010254464 [0,2,0,0,0,0|1,0,0]=3 776 B23R2.22871 CCCC(C)CCOCc1ccccc1Oc2ccccc2 7a_100011217855_100000199117 [0,2,0,0,0,0|2,0,0]=4 777 B23R2.27394 CCC(C)CCCOCc1ccccc1Cc2ccccc2 7a_100011216074_100010254464 [0,2,0,0,0,0|1,0,0]=3 778 B23R2.27394 CCC(C)CCCOCc1ccccc1Oc2ccccc2 7a_100011216074_100000199117 [0,2,0,0,0,0|2,0,0]=4 779 B23R2.28636 BrCCCCCCOCc1ccccc1Cc2ccccc2 34a_100011215345_100010254464 [0,2,0,0,0,0|1,0,0]=3 780 B23R2.28636 BrCCCCCCOCc1ccccc1Cc2ccccc2 7a_100011215345_100010254464 [0,2,0,0,0,0|1,0,0]=3 781 B23R2.28636 BrCCCCCCOCc1ccccc1Oc2ccccc2 7a_100011215345_100000199117 [0,2,0,0,0,0|2,0,0]=4 782 B23R2.28636 C#CCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100012276617 [0,2,0,0,0,0|2,0,0]=4 783 B23R2.28636 C#CCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100012276617 [0,2,0,0,0,0|2,0,0]=4 784 B23R2.28636 C#CCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100012276617 [0,2,0,0,0,0|2,0,0]=4 785 B23R2.28636 C#CCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100012276617 [0,2,0,0,0,0|1,0,0]=3 786 B23R2.28636 C#CCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100012276617 [0,2,0,0,0,0|1,0,0]=3 787 B23R2.28636 C#CCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100012276617 [0,2,0,0,0,0|2,0,0]=4 788 B23R2.28636 C#CCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100012276617 [0,2,0,0,0,0|2,0,0]=4 789 B23R2.28636 C#CCCCCCCSc1ccccc1Cc2ccccc2 62a_100012276617_200011216382 [0,2,0,0,0,0|1,1,0]=4 790 B23R2.28636 C#CCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100012276617 [0,2,0,0,0,0|1,1,0]=4 791 B23R2.28636 C=CCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100011215473 [0,2,0,0,0,0|2,0,0]=4 792 B23R2.28636 C=CCCCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100011215473 [0,2,0,0,0,0|2,0,0]=4 793 B23R2.28636 C=CCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100011215473 [0,2,0,0,0,0|2,0,0]=4 794 B23R2.28636 C=CCCCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100011215473 [0,2,0,0,0,0|1,0,0]=3 795 B23R2.28636 C=CCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100011215473 [0,2,0,0,0,0|1,0,0]=3 796 B23R2.28636 C=CCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011215473 [0,2,0,0,0,0|2,0,0]=4 797 B23R2.28636 C=CCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011215473 [0,2,0,0,0,0|2,0,0]=4 798 B23R2.28636 C=CCCCCCOCc1ccccc1Cc2ccccc2 34a_100011216702_100010254464 [0,2,0,0,0,0|1,0,1]=4 799 B23R2.28636 C=CCCCCCOCc1ccccc1Cc2ccccc2 7a_100011216702_100010254464 [0,2,0,0,0,0|1,0,1]=4 800 B23R2.28636 CC/C=C/CCCOCc1ccccc1Cc2ccccc2 34a_100016287902_100010254464 [0,2,0,0,0,0|1,0,1]=4 801 B23R2.28636 CC/C=C/CCCOCc1ccccc1Cc2ccccc2 7a_100016287902_100010254464 [0,2,0,0,0,0|1,0,1]=4 802 B23R2.28636 CCCC/C=C/COCc1ccccc1Cc2ccccc2 34a_200016272032_100010254464 [0,2,0,0,0,0|1,0,1]=4 803 B23R2.28636 CCCC/C=C/COCc1ccccc1Cc2ccccc2 7a_200016272032_100010254464 [0,2,0,0,0,0|1,0,1]=4 804 B23R2.28636 CCCCCC#CCNc1ccccc1Cc2ccccc2 2230a_100000211252_100009816472 [0,2,0,0,0,0|2,0,0]=4 805 B23R2.28636 CCCCCC#CCNc1ccccc1Cc2ccccc2 34a_100000211252_100009816472 [0,2,0,0,0,0|2,0,0]=4 806 B23R2.28636 CCCCCC#CCNc1ccccc1Cc2ccccc2 7a_100000211252_100009816472 [0,2,0,0,0,0|2,0,0]=4 807 B23R2.28636 CCCCCC#CCOc1ccccc1Cc2ccccc2 34a_100000211249_100009816472 [0,2,0,0,0,0|1,0,0]=3 808 B23R2.28636 CCCCCC#CCOc1ccccc1Cc2ccccc2 7a_100000211249_100009816472 [0,2,0,0,0,0|1,0,0]=3 809 B23R2.28636 CCCCCC#CCOc1ccccc1Oc2ccccc2 34a_100000074787_100009816472 [0,2,0,0,0,0|2,0,0]=4 810 B23R2.28636 CCCCCC#CCOc1ccccc1Oc2ccccc2 7a_100000074787_100009816472 [0,2,0,0,0,0|2,0,0]=4 811 B23R2.28636 CCCCCC#CCSc1ccccc1Cc2ccccc2 62a_100009816472_200011216382 [0,2,0,0,0,0|1,1,0]=4 812 B23R2.28636 CCCCCC#CCSc1ccccc1Cc2ccccc2 62a_200011216382_100009816472 [0,2,0,0,0,0|1,1,0]=4 813 B23R2.28636 CCCCCCCNCc1ccccc1Cc2ccccc2 207a_100000229938_100009842342 [0,2,0,0,0,0|2,0,0]=4 814 B23R2.28636 CCCCCCCNCc1ccccc1Cc2ccccc2 2230a_100000229938_100010254464 [0,2,0,0,0,0|2,0,0]=4 815 B23R2.28636 CCCCCCCNCc1ccccc1Cc2ccccc2 270004a_100000229938_100009842342 [0,2,0,0,0,0|2,0,0]=4 816 B23R2.28636 CCCCCCCOCc1ccccc1Cc2ccccc2 34a_100000210272_100010254464 [0,2,0,0,0,0|1,0,0]=3 817 B23R2.28636 CCCCCCCOCc1ccccc1Cc2ccccc2 7a_100000210272_100010254464 [0,2,0,0,0,0|1,0,0]=3 818 B23R2.28636 CCCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100000210614 [0,2,0,0,0,0|2,0,0]=4 819 B23R2.28636 CCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000210272_100000199117 [0,2,0,0,0,0|2,0,0]=4 820 B23R2.28636 CCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100000210614 [0,2,0,0,0,0|2,0,0]=4 821 B23R2.28636 CCCCOCCSCc1ccccc1Cc2ccccc2 62a_100000743108_100010254464 [0,2,0,0,0,0|1,1,0]=4 822 B23R2.28636 CCCCOCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000743108 [0,2,0,0,0,0|1,1,0]=4 823 B23R2.28636 CCCCSCCOCc1ccccc1Cc2ccccc2 34a_200000230436_100010254464 [0,2,0,0,0,0|1,0,0]=3 824 B23R2.28636 CCCCSCCOCc1ccccc1Cc2ccccc2 7a_200000230436_100010254464 [0,2,0,0,0,0|1,0,0]=3 825 B23R2.28636 CCCCSCCOCc1ccccc1Oc2ccccc2 7a_200000230436_100000199117 [0,2,0,0,0,0|2,0,0]=4 826 B23R2.28636 COCCCCCCOc1ccccc1Oc2ccccc2 34a_100000074787_100011998445 [0,2,0,0,0,0|2,0,0]=4 827 B23R2.28636 COCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100011998445 [0,2,0,0,0,0|2,0,0]=4 828 B23R2.28636 COCCCCCCSc1ccccc1Cc2ccccc2 62a_100011998445_200011216382 [0,2,0,0,0,0|1,1,0]=4 829 B23R2.28636 COCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100011998445 [0,2,0,0,0,0|1,1,0]=4 830 B23R2.28636 ClCCCCCCOCc1ccccc1Cc2ccccc2 34a_100000766143_100010254464 [0,2,0,0,0,0|1,0,0]=3 831 B23R2.28636 ClCCCCCCOCc1ccccc1Cc2ccccc2 7a_100000766143_100010254464 [0,2,0,0,0,0|1,0,0]=3 832 B23R2.28636 ClCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000766143_100000199117 [0,2,0,0,0,0|2,0,0]=4 833 B23R2.28636 FCCCCCCOCc1ccccc1Cc2ccccc2 34a_100000732779_100010254464 [0,2,0,0,0,0|1,0,0]=3 834 B23R2.28636 FCCCCCCOCc1ccccc1Cc2ccccc2 7a_100000732779_100010254464 [0,2,0,0,0,0|1,0,0]=3 835 B23R2.28636 FCCCCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100015922095 [0,2,0,0,0,0|2,0,0]=4 836 B23R2.28636 FCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100015922095 [0,2,0,0,0,0|2,0,0]=4 837 B23R2.28636 FCCCCCCOCc1ccccc1Oc2ccccc2 7a_100000732779_100000199117 [0,2,0,0,0,0|2,0,0]=4 838 B23R2.28636 N#CCCCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100009813337 [0,2,0,0,0,0|2,0,0]=4 839 B23R2.28636 N#CCCCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100009813337 [0,2,0,0,0,0|2,0,0]=4 840 B23R2.28636 N#CCCCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100009813337 [0,2,0,0,0,0|1,0,0]=3 841 B23R2.28636 N#CCCCCCCOc1ccccc1Oc2ccccc2 7a_100000074787_100009813337 [0,2,0,0,0,0|2,0,0]=4 842 B23R2.28636 N#CCCCCCCSc1ccccc1Cc2ccccc2 62a_100009813337_200011216382 [0,2,0,0,0,0|1,1,0]=4 843 B23R2.28636 N#CCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100009813337 [0,2,0,0,0,0|1,1,0]=4 844 B23R2.28636 OCCCCCCCSc1ccccc1Cc2ccccc2 62a_100000760002_200011216382 [0,2,0,0,0,0|1,1,0]=4 845 B23R2.28636 OCCCCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_100000760002 [0,2,0,0,0,0|1,1,0]=4 846 B23R2.28636 OCCCCCCSCc1ccccc1Cc2ccccc2 62a_100000766143_100010254464 [0,2,0,0,0,0|1,1,0]=4 847 B23R2.28636 OCCCCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000766143 [0,2,0,0,0,0|1,1,0]=4 848 B23R2.29520 CC(=O)CCCCSCc1ccccc1Cc2ccccc2 62a_100000735457_100010254464 [0,2,0,0,0,0|1,1,0]=4 849 B23R2.29520 CC(=O)CCCCSCc1ccccc1Cc2ccccc2 62a_100010254464_100000735457 [0,2,0,0,0,0|1,1,0]=4 850 B23R2.29520 CC(=O)SCCCCSc1ccccc1Cc2ccccc2 62a_200010402107_200011216382 [0,2,0,0,0,0|1,1,0]=4 851 B23R2.29520 CC(=O)SCCCCSc1ccccc1Cc2ccccc2 62a_200011216382_200010402107 [0,2,0,0,0,0|1,1,0]=4 852 B23R2.29520 CC(C)CCCCCNc1ccccc1Cc2ccccc2 2230a_100000211252_100000210682 [0,2,0,0,0,0|2,0,0]=4 853 B23R2.29520 CC(C)CCCCCNc1ccccc1Cc2ccccc2 34a_100000211252_100000210682 [0,2,0,0,0,0|2,0,0]=4 854 B23R2.29520 CC(C)CCCCCNc1ccccc1Cc2ccccc2 7a_100000211252_100000210682 [0,2,0,0,0,0|2,0,0]=4 855 B23R2.29520 CC(C)CCCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000210682 [0,2,0,0,0,0|1,0,0]=3 856 B23R2.29520 CC(C)CCCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000210682 [0,2,0,0,0,0|1,0,0]=3 857 B23R2.29520 CC(C)CCCCOCc1ccccc1Cc2ccccc2 34a_100011214890_100010254464 [0,2,0,0,0,0|1,0,0]=3 858 B23R2.29520 CC(C)CCCCOCc1ccccc1Cc2ccccc2 7a_100011214890_100010254464 [0,2,0,0,0,0|1,0,0]=3 859 B23R2.29520 CC(C)CCCCOCc1ccccc1Oc2ccccc2 34a_100000246416_100011216152 [0,2,0,0,0,0|2,0,0]=4 860 B23R2.29520 CC(C)CCCCOCc1ccccc1Oc2ccccc2 7a_100000246416_100011216152 [0,2,0,0,0,0|2,0,0]=4 861 B23R2.29520 CC(C)CCCCOCc1ccccc1Oc2ccccc2 7a_100011214890_100000199117 [0,2,0,0,0,0|2,0,0]=4 862 B23R2.29520 CC(C)CSCCOCc1ccccc1Cc2ccccc2 34a_200000230437_100010254464 [0,2,0,0,0,0|2,0,0]=4 863 B23R2.29520 CC(C)CSCCOCc1ccccc1Cc2ccccc2 7a_200000230437_100010254464 [0,2,0,0,0,0|2,0,0]=4 864 B23R2.29520 CN(C)CCCCSCc1ccccc1Oc2ccccc2 62a_100000199117_100000690147 [0,2,0,0,0,0|1,1,0]=4 865 B23R2.33313 CCCCC(C)COCc1ccccc1Cc2ccccc2 34a_100011995851_100010254464 [0,2,0,0,0,0|1,0,0]=3 866 B23R2.33313 CCCCC(C)COCc1ccccc1Cc2ccccc2 7a_100011995851_100010254464 [0,2,0,0,0,0|1,0,0]=3 867 B23R2.33313 CCCCC(C)COCc1ccccc1Oc2ccccc2 7a_100011995851_100000199117 [0,2,0,0,0,0|2,0,0]=4 868 B23R2.186195 CCCCCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100000210614 [0,2,0,0,0,0|2,0,0]=4 869 B23R2.186195 O=C(CCCCCCF)c1ccccc1Cc2ccccc2 1458a_100000211042_100015922095 [0,2,0,0,0,0|2,0,0]=4 870 B23R2.939005 CCCCCCC=Cc1ccccc1C(N)c2ccccc2 271570a_200015348155_100011211563 [0,2,0,0,0,0|2,0,0]=4 871 B23R2.939005 CCCCCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100000210681 [0,2,0,0,0,0|2,0,0]=4 872 B23R2.939005 CCCCCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100000210614 [0,2,0,0,0,0|2,0,0]=4 873 B23R2.939005 CCCCCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100000210614 [0,2,0,0,0,0|2,0,0]=4 874 B23R2.939005 CCCCCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100000210614 [0,2,0,0,0,0|1,0,1]=4 875 B23R2.939005 CCCCCCCSc1ccccc1C(N)c2ccccc2 62a_100000210614_100011211563 [0,2,0,0,0,0|1,1,0]=4 876 B23R2.939005 CCCCCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100000210316 [0,2,0,0,0,0|1,1,0]=4 877 B23R2.939005 NC(c1ccccc1)c2ccccc2SCCCCCCF 62a_100011211563_100015922095 [0,2,0,0,0,0|1,1,0]=4 878 B23R2.939005 NC(c1ccccc1)c2ccccc2SCCCCCCF 62a_100015922095_100011211563 [0,2,0,0,0,0|1,1,0]=4 879 B23R2.4042 CN(C)CCCCSc1ccccc1Oc2ccc(cc2)F 62a_200010782033_100000690147 [0,2,0,0,0,0|1,1,0]=4 880 B23R2.58972 FC(F)(F)CCCCOc1ccccc1Cc2ccccc2 34a_100000211249_100000692467 [0,2,0,0,0,0|2,0,0]=4 881 B23R2.58972 FC(F)(F)CCCCOc1ccccc1Cc2ccccc2 7a_100000211249_100000692467 [0,2,0,0,0,0|2,0,0]=4 882 B23R2.183410 CC(=O)CCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_100009817362 [0,2,0,0,0,0|1,0,0]=3 883 B23R2.183410 CC(=O)CCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_100000735457 [0,2,0,0,0,0|1,0,0]=3 884 B23R2.183410 CC(=S)OCCCOc1ccc(cc1Cc2ccccc2)Cl 34a_100000211996_200135323944 [0,2,0,0,0,0|2,0,0]=4 885 B23R2.183410 CC(=S)OCCCOc1ccc(cc1Cc2ccccc2)Cl 7a_100000211996_200135323944 [0,2,0,0,0,0|2,0,0]=4 886 B23R2.471020 CC(C)CCCCC(=O)c1ccccc1Cc2ccccc2 1458a_100000211042_100011216152 [0,2,0,0,0,0|2,0,0]=4 887 B23R2.472247 CC(C)CCCCNc1ccccc1C(O)c2ccccc2 2230a_100000246470_100011216152 [0,2,0,0,0,0|2,0,0]=4 888 B23R2.472247 CC(C)CCCCNc1ccccc1C(O)c2ccccc2 34a_100000246470_100011216152 [0,2,0,0,0,0|2,0,0]=4 889 B23R2.472247 CC(C)CCCCNc1ccccc1C(O)c2ccccc2 7a_100000246470_100011216152 [0,2,0,0,0,0|2,0,0]=4 890 B23R2.472247 CC(C)CCCCOc1ccccc1C(=O)c2ccccc2 7a_100011215220_100011216152 [0,2,0,0,0,0|1,0,1]=4 891 B23R2.472247 CC(C)CCCCSc1ccccc1C(N)c2ccccc2 62a_100011211563_100011216152 [0,2,0,0,0,0|1,1,0]=4 892 B23R2.472247 CC(C)CCCCSc1ccccc1C(N)c2ccccc2 62a_100011216152_100011211563 [0,2,0,0,0,0|1,1,0]=4 893 B23R2.31770 CCCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 2230a_100000011915_100000210314 [0,2,0,0,0,0|2,0,0]=4 894 B23R2.31770 CCCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 34a_100000011915_100000210314 [0,2,0,0,0,0|2,0,0]=4 895 B23R2.31770 CCCCCCNc1ccc(cc1C(O)c2ccccc2)Cl 7a_100000011915_100000210314 [0,2,0,0,0,0|2,0,0]=4 896 B23R2.31770 CCCCCCOc1ccc(cc1C(=O)c2ccccc2)Br 7a_200011217964_100000210314 [0,2,0,0,0,0|1,0,1]=4 897 B23R2.31770 CCCCCCOc1ccc(cc1C(=O)c2ccccc2)C 7a_100011219697_100000210314 [0,2,0,0,0,0|1,0,1]=4 898 B23R2.31770 CCCCCCOc1ccc(cc1C(=O)c2ccccc2)Cl 34a_100011215916_100000210314 [0,2,0,0,0,0|1,0,1]=4 899 B23R2.31770 CCCCCCOc1ccc(cc1C(=O)c2ccccc2)Cl 7a_100011215916_100000210314 [0,2,0,0,0,0|1,0,1]=4 900 B23R2.38921 CCCCC(CC)CNc1ccccc1Cc2ccccc2 2230a_100000211252_100000211942 [0,2,0,0,0,0|2,0,0]=4 901 B23R2.38921 CCCCC(CC)CNc1ccccc1Cc2ccccc2 34a_100000211252_100000211942 [0,2,0,0,0,0|2,0,0]=4 902 B23R2.38921 CCCCC(CC)CNc1ccccc1Cc2ccccc2 7a_100000211252_100000211942 [0,2,0,0,0,0|2,0,0]=4 903 B23R2.38921 CCCCC(CC)COc1ccccc1Cc2ccccc2 34a_100000211249_100000211942 [0,2,0,0,0,0|1,0,0]=3 904 B23R2.38921 CCCCC(CC)COc1ccccc1Cc2ccccc2 7a_100000211249_100000211942 [0,2,0,0,0,0|1,0,0]=3 905 B23R2.154258 CCCC[Si](C)(C)COc1ccccc1Cc2ccccc2 7a_100000211249_200000073895 [0,2,0,0,0,0|1,1,0]=4 906 B23R2.41902 CCCCCCOc1cc(ccc1C(=O)c2ccccc2)C 7a_100000066476_100000210314 [0,2,0,0,0,0|1,0,1]=4 907 B21R3.57 C1=C(CCCC1)c2ccccc2Cc3ccccc3 271570a_100000062251_200011216382 [1,0,0,1,0,0|1,0,1]=4 908 B21R3.57 c1ccc(cc1)Sc2ccccc2C3CCCCC3 62a_100000719477_200009813743 [1,0,0,1,0,0|2,0,0]=4 909 B21R3.57 c1ccc(cc1)Sc2ccccc2C3CCCCC3 62a_200009813743_100000041952 [1,0,0,1,0,0|2,0,0]=4 910 B21R3.3142 C(=C1CCCC1)c2ccccc2Cc3ccccc3 271570a_100010378317_200011216382 [1,0,0,1,0,0|1,0,1]=4 911 B21R3.3142 c1ccc(cc1)Cc2ccccc2SC3CCCC3 62a_100011217020_200011216382 [1,0,0,1,0,0|0,1,0]=3 912 B21R3.3142 c1ccc(cc1)Cc2ccccc2SC3CCCC3 62a_200011216382_100000179811 [1,0,0,1,0,0|0,1,0]=3 913 B21R3.3142 c1ccc(cc1)Nc2ccccc2SC3CCCC3 62a_100011217020_100009815782 [1,0,0,1,0,0|1,1,0]=4 914 B21R3.3142 c1ccc(cc1)Oc2ccccc2SC3CCCC3 62a_100011217020_100000049502 [1,0,0,1,0,0|1,1,0]=4 915 B21R3.3142 c1ccc(cc1)Sc2ccccc2NC3CCCC3 2230a_100000210917_100000179811 [1,0,0,1,0,0|2,0,0]=4 916 B21R3.3142 c1ccc(cc1)Sc2ccccc2OC3CCCC3 62a_100000719477_100011214840 [1,0,0,1,0,0|1,0,0]=3 917 B21R3.3142 c1ccc(cc1)Sc2ccccc2OC3CCCC3 62a_100011214840_100000041952 [1,0,0,1,0,0|1,0,0]=3 918 B21R3.47878 c1ccc(cc1)Cc2ccccc2SCCC3CC3 62a_100000764125_200011216382 [1,0,0,1,0,0|0,1,0]=3 919 B21R3.47878 c1ccc(cc1)Cc2ccccc2SCCC3CC3 62a_200011216382_100000764125 [1,0,0,1,0,0|0,1,0]=3 920 B21R3.47878 c1ccc(cc1)Nc2ccccc2SCCC3CC3 62a_100000764125_100009815782 [1,0,0,1,0,0|1,1,0]=4 921 B21R3.47878 c1ccc(cc1)Oc2ccccc2SCCC3CC3 62a_100000764125_100000049502 [1,0,0,1,0,0|1,1,0]=4 922 B21R3.47878 c1ccc(cc1)Sc2ccccc2NCCC3CC3 2230a_100000210917_100000694398 [1,0,0,1,0,0|2,0,0]=4 923 B21R3.47892 c1ccc(cc1)Cc2ccccc2CSC3CCC3 62a_100010254464_100000749161 [1,0,0,1,0,0|2,0,0]=4 924 B21R3.47892 c1ccc(cc1)Cc2ccccc2SCC3CCC3 62a_100000763275_200011216382 [1,0,0,1,0,0|0,1,0]=3 925 B21R3.47892 c1ccc(cc1)Cc2ccccc2SCC3CCC3 62a_200011216382_100000763275 [1,0,0,1,0,0|0,1,0]=3 926 B21R3.47892 c1ccc(cc1)Nc2ccccc2SCC3CCC3 62a_100000763275_100009815782 [1,0,0,1,0,0|1,1,0]=4 927 B21R3.47892 c1ccc(cc1)Oc2ccccc2SCC3CCC3 62a_100000763275_100000049502 [1,0,0,1,0,0|1,1,0]=4 928 B21R3.47892 c1ccc(cc1)Sc2ccccc2NCC3CCC3 2230a_100000210917_100000763275 [1,0,0,1,0,0|2,0,0]=4 929 B21R3.146522 CCCCCNc1cccc2c1oc3c2cccc3 34a_200000102501_100000718602 [1,0,0,1,0,0|2,0,0]=4 930 B21R3.146522 CCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000718602 [1,0,0,1,0,0|1,0,0]=3 931 B21R3.146522 CCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000210326 [1,0,0,1,0,0|1,0,0]=3 932 B21R3.3128 c1ccc(cc1)c2ccccc2SCC3CCCC3 62a_100000033479_100000740388 [0,0,0,1,1,0|1,1,0]=4 933 B21R3.3128 c1ccc(cc1)c2ccccc2SCC3CCCC3 62a_100000740388_100000033479 [0,0,0,1,1,0|1,1,0]=4 934 B23R3.1974195 c1ccc(cc1)COc2ccccc2SCC3CCCC3 62a_100000151716_100000740388 [0,0,0,1,0,1|1,1,0]=4 935 B23R3.1974195 c1ccc(cc1)COc2ccccc2SCC3CCCC3 62a_100000740388_100000151716 [0,0,0,1,0,1|1,1,0]=4 936 B23R3.1974195 c1ccc(cc1)CSc2ccccc2NCC3CCCC3 34a_100000198535_100000740388 [0,0,0,1,0,1|2,0,0]=4 937 B23R3.1974195 c1ccc(cc1)CSc2ccccc2NCC3CCCC3 7a_100000198535_100000740388 [0,0,0,1,0,1|2,0,0]=4 938 B23R3.1974227 C(=Cc1ccccc1OC2CCCCC2)c3ccccc3 271570a_100102527694_200011235867 [0,0,0,1,0,1|1,0,1]=4 939 B23R3.1974227 c1ccc(c(c1)OC2CCCCC2)SCc3ccncc3 62a_100015193705_200011235867 [0,0,0,1,0,1|2,0,0]=4 940 B23R3.1974227 c1ccc(c(c1)OC2CCCCC2)SCc3ccncc3 62a_200011235867_100015193705 [0,0,0,1,0,1|2,0,0]=4 941 B23R3.1974227 c1ccc(cc1)CNc2ccccc2SC3CCCCC3 207a_100011235873_100015611070 [0,0,0,1,0,1|1,1,0]=4 942 B23R3.1974227 c1ccc(cc1)CNc2ccccc2SC3CCCCC3 270302a_100011235873_100015611070 [0,0,0,1,0,1|1,1,0]=4 943 B23R3.1974227 c1ccc(cc1)CNc2ccccc2SC3CCCCC3 34a_100011235873_100015291786 [0,0,0,1,0,1|1,1,0]=4 944 B23R3.1974227 c1ccc(cc1)CNc2ccccc2SC3CCCCC3 7a_100011235873_100000211182 [0,0,0,1,0,1|1,1,0]=4 945 B23R3.1974227 c1ccc(cc1)COc2ccccc2CC3CCCCC3 34a_200009881200_100015291786 [0,0,0,1,0,1|2,0,0]=4 946 B23R3.1974227 c1ccc(cc1)COc2ccccc2CC3CCCCC3 7a_200009881200_100000211182 [0,0,0,1,0,1|2,0,0]=4 947 B23R3.1974227 c1ccc(cc1)COc2ccccc2NC3CCCCC3 34a_100011193923_100000210327 [0,0,0,1,0,1|2,0,0]=4 948 B23R3.1974227 c1ccc(cc1)COc2ccccc2SC3CCCCC3 62a_100000151716_100000210327 [0,0,0,1,0,1|1,1,0]=4 949 B23R3.1974227 c1ccc(cc1)COc2ccccc2SC3CCCCC3 62a_100000210327_100000151716 [0,0,0,1,0,1|1,1,0]=4 950 B23R3.1974227 c1ccc(cc1)CSc2ccccc2NC3CCCCC3 34a_100000198535_100000210327 [0,0,0,1,0,1|2,0,0]=4 951 B23R3.1974227 c1ccc(cc1)CSc2ccccc2NC3CCCCC3 7a_100000198535_100000210327 [0,0,0,1,0,1|2,0,0]=4 952 B23R3.1974227 c1ccc(cc1)CSc2ccccc2OC3CCCCC3 62a_100000211182_200011235867 [0,0,0,1,0,1|1,0,0]=3 953 B23R3.1974227 c1ccc(cc1)CSc2ccccc2OC3CCCCC3 62a_200011235867_100015291786 [0,0,0,1,0,1|1,0,0]=3 954 B23R3.1974227 c1ccc(cc1)OCc2ccccc2NC3CCCCC3 34a_100000742786_100000210327 [0,0,0,1,0,1|2,0,0]=4 955 B23R3.1974227 c1ccc(cc1)OCc2ccccc2NC3CCCCC3 7a_100000742786_100000210327 [0,0,0,1,0,1|2,0,0]=4 956 B23R3.1974227 c1ccc(nc1)CSc2ccccc2OC3CCCCC3 62a_100000721315_200011235867 [0,0,0,1,0,1|2,0,0]=4 957 B23R3.1974227 c1ccc(nc1)CSc2ccccc2OC3CCCCC3 62a_200011235867_100000721315 [0,0,0,1,0,1|2,0,0]=4 958 B23R3.1974227 c1cncc(c1)CSc2ccccc2OC3CCCCC3 62a_100000741622_200011235867 [0,0,0,1,0,1|2,0,0]=4 959 B23R3.1974227 c1cncc(c1)CSc2ccccc2OC3CCCCC3 62a_200011235867_100000741622 [0,0,0,1,0,1|2,0,0]=4 960 B23R3.16472 Cc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_100011215228_200011235867 [0,1,0,1,0,0|2,0,0]=4 961 B23R3.16472 Cc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100011215228 [0,1,0,1,0,0|2,0,0]=4 962 B23R3.16472 Fc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_100000685547_200011235867 [0,1,0,1,0,0|2,0,0]=4 963 B23R3.16472 Fc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000685547 [0,1,0,1,0,0|2,0,0]=4 964 B23R3.16472 Nc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_100000210019_200011235867 [0,1,0,1,0,0|2,0,0]=4 965 B23R3.16472 Nc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000210019 [0,1,0,1,0,0|2,0,0]=4 966 B23R3.16472 Oc1cccc(c1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000211634 [0,1,0,1,0,0|2,0,0]=4 967 B23R3.1944951 CCCCCC(C)Oc1cccc2c1oc3c2cccc3 34a_100010256078_200011218191 [0,1,0,1,0,0|2,0,0]=4 968 B23R3.1944951 CCCCCC(C)Oc1cccc2c1oc3c2cccc3 7a_100010256078_200011218191 [0,1,0,1,0,0|2,0,0]=4 969 B23R3.4596 C(#Cc1ccccc1Cc2ccccc2)CC3CCCC3 271570a_200010126907_200011216382 [0,1,0,1,0,0|2,0,0]=4 970 B23R3.4596 C(=Cc1ccccc1Cc2ccccc2)CC3CCCC3 271570a_200000069456_200011216382 [0,1,0,1,0,0|2,0,0]=4 971 B23R3.4596 c1ccc(cc1)Cc2ccccc2CSCC3CCCC3 62a_100000740388_100010254464 [0,1,0,1,0,0|1,1,0]=4 972 B23R3.4596 c1ccc(cc1)Cc2ccccc2CSCC3CCCC3 62a_100010254464_100000740388 [0,1,0,1,0,0|1,1,0]=4 973 B23R3.4596 c1ccc(cc1)Cc2ccccc2NCCC3CCCC3 2230a_100000211252_100000760354 [0,1,0,1,0,0|2,0,0]=4 974 B23R3.4596 c1ccc(cc1)Cc2ccccc2NCCC3CCCC3 34a_100000211252_100000760354 [0,1,0,1,0,0|2,0,0]=4 975 B23R3.4596 c1ccc(cc1)Cc2ccccc2NCCC3CCCC3 7a_100000211252_100000760354 [0,1,0,1,0,0|2,0,0]=4 976 B23R3.4596 c1ccc(cc1)Cc2ccccc2OCCC3CCCC3 34a_100000211249_100000760354 [0,1,0,1,0,0|1,0,0]=3 977 B23R3.4596 c1ccc(cc1)Cc2ccccc2OCCC3CCCC3 7a_100000211249_100000760354 [0,1,0,1,0,0|1,0,0]=3 978 B23R3.4596 c1ccc(cc1)Cc2ccccc2SCCC3CCCC3 62a_100000760354_200011216382 [0,1,0,1,0,0|1,1,0]=4 979 B23R3.4596 c1ccc(cc1)Cc2ccccc2SCCC3CCCC3 62a_200011216382_100000760354 [0,1,0,1,0,0|1,1,0]=4 980 B23R3.4596 c1ccc(cc1)Oc2ccccc2COCC3CCCC3 34a_100000246416_100000740388 [0,1,0,1,0,0|2,0,0]=4 981 B23R3.4596 c1ccc(cc1)Oc2ccccc2COCC3CCCC3 7a_100000246416_100000740388 [0,1,0,1,0,0|2,0,0]=4 982 B23R3.4596 c1ccc(cc1)Oc2ccccc2COCC3CCCC3 7a_100000742336_100000199117 [0,1,0,1,0,0|2,0,0]=4 983 B23R3.4596 c1ccc(cc1)Oc2ccccc2OCCC3CCCC3 34a_100000074787_100000760354 [0,1,0,1,0,0|2,0,0]=4 984 B23R3.4596 c1ccc(cc1)Oc2ccccc2OCCC3CCCC3 7a_100000074787_100000760354 [0,1,0,1,0,0|2,0,0]=4 985 B23R3.41065 CC1CCCC1OCc2ccccc2Oc3ccccc3 7a_100011216460_100000199117 [0,1,0,1,0,0|2,0,0]=4 986 B23R3.41961 Cc1ccccc1Sc2ccccc2OC3CCCCC3 62a_100000210755_200011235867 [0,1,0,1,0,0|2,0,0]=4 987 B23R3.41961 Cc1ccccc1Sc2ccccc2OC3CCCCC3 62a_200011235867_100000210755 [0,1,0,1,0,0|2,0,0]=4 988 B23R3.41961 FC1CCCCC1Oc2ccccc2Oc3ccccc3 34a_100000074787_100015423560 [0,1,0,1,0,0|2,0,0]=4 989 B23R3.41961 FC1CCCCC1Sc2ccccc2Cc3ccccc3 62a_100015423560_200011216382 [0,1,0,1,0,0|1,1,0]=4 990 B23R3.41961 FC1CCCCC1Sc2ccccc2Cc3ccccc3 62a_200011216382_100015423560 [0,1,0,1,0,0|1,1,0]=4 991 B23R3.41961 Fc1ccccc1Sc2ccccc2OC3CCCCC3 62a_100011215700_200011235867 [0,1,0,1,0,0|2,0,0]=4 992 B23R3.41961 Fc1ccccc1Sc2ccccc2OC3CCCCC3 62a_200011235867_100011215700 [0,1,0,1,0,0|2,0,0]=4 993 B23R3.41961 Nc1ccccc1Sc2ccccc2OC3CCCCC3 62a_100000210017_200011235867 [0,1,0,1,0,0|2,0,0]=4 994 B23R3.41961 Nc1ccccc1Sc2ccccc2OC3CCCCC3 62a_200011235867_100000210017 [0,1,0,1,0,0|2,0,0]=4 995 B23R3.41961 Oc1ccccc1Sc2ccccc2OC3CCCCC3 62a_100000739446_200011235867 [0,1,0,1,0,0|2,0,0]=4 996 B23R3.41961 Oc1ccccc1Sc2ccccc2OC3CCCCC3 62a_200011235867_100000739446 [0,1,0,1,0,0|2,0,0]=4 997 B23R3.958723 CCCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000210614 [0,1,0,1,0,0|2,0,0]=4 998 B23R3.958723 CCCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000210614 [0,1,0,1,0,0|2,0,0]=4 999 B23R3.958723 FCCCCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100015922095 [0,1,0,1,0,0|2,0,0]=4 1000 B23R3.958723 FCCCCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100015922095 [0,1,0,1,0,0|2,0,0]=4 1001 B23R3.31995510 CCCCCCOC1c2ccccc2Oc3c1cccc3 7a_100000210167_100000210314 [0,1,0,1,0,0|2,0,0]=4 1002 B23R3.920838 CC(C)CCCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100011216152 [0,1,0,1,0,0|2,0,0]=4 1003 B23R3.920838 CC(C)CCCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100011216152 [0,1,0,1,0,0|2,0,0]=4 1004 B23R3.67825 CC1CCC(CC1)Nc2ccccc2Cc3ccccc3 34a_100000211252_200011216234 [0,1,0,1,0,0|2,0,0]=4 1005 B23R3.67825 CC1CCC(CC1)Oc2ccccc2Cc3ccccc3 34a_100000211249_200011216234 [0,1,0,1,0,0|1,0,0]=3 1006 B23R3.67825 CC1CCC(CC1)Oc2ccccc2Oc3ccccc3 34a_100000074787_200011216234 [0,1,0,1,0,0|2,0,0]=4 1007 B23R3.67825 CC1CCC(CC1)Sc2ccccc2Cc3ccccc3 62a_200011216382_200011216234 [0,1,0,1,0,0|1,1,0]=4 1008 B23R3.67825 Cc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_100000186775_200011235867 [0,1,0,1,0,0|2,0,0]=4 1009 B23R3.67825 Cc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000186775 [0,1,0,1,0,0|2,0,0]=4 1010 B23R3.67825 Fc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_100000211213_200011235867 [0,1,0,1,0,0|2,0,0]=4 1011 B23R3.67825 Fc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000211213 [0,1,0,1,0,0|2,0,0]=4 1012 B23R3.67825 Nc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_100000185761_200011235867 [0,1,0,1,0,0|2,0,0]=4 1013 B23R3.67825 Nc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000185761 [0,1,0,1,0,0|2,0,0]=4 1014 B23R3.67825 Oc1ccc(cc1)Sc2ccccc2OC3CCCCC3 62a_200011235867_100000185759 [0,1,0,1,0,0|2,0,0]=4 1015 B23R3.4556960 CCCCCCOc1cccc2c1oc3c2cc(cc3)F 34a_100160571805_100000210314 [0,1,0,1,0,0|2,0,0]=4 1016 B23R3.4556960 CCCCCCOc1cccc2c1oc3c2cc(cc3)F 7a_100160571805_100000210314 [0,1,0,1,0,0|2,0,0]=4 1017 B23R3.17829 Clc1ccc(c(c1)Cc2ccccc2)OCC3CCCC3 34a_100000211996_100000740388 [0,1,0,1,0,0|1,0,0]=3 1018 B23R3.17829 Clc1ccc(c(c1)Cc2ccccc2)OCC3CCCC3 7a_100000211996_100000740388 [0,1,0,1,0,0|1,0,0]=3 1019 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3C=CCCC3 7a_100000211996_100000751183 [0,1,0,1,0,0|1,0,1]=4 1020 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCCCC3 34a_100000211996_100000210327 [0,1,0,1,0,0|1,0,0]=3 1021 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCCCC3 7a_100000211996_100000210327 [0,1,0,1,0,0|1,0,0]=3 1022 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCSCC3 34a_100000211996_100000069128 [0,1,0,1,0,0|2,0,0]=4 1023 B23R3.44768 Clc1ccc(c(c1)Cc2ccccc2)OC3CCSCC3 7a_100000211996_100011500858 [0,1,0,1,0,0|2,0,0]=4 1024 B23R3.940728 O=C(CC1CCCC1)c2ccccc2Cc3ccccc3 1458a_100000211042_100000740388 [0,1,0,1,0,0|2,0,0]=4 1025 B23R3.1995329 C=C(c1ccccc1)c2ccccc2OC3CCCCC3 271570a_100000068269_200011235867 [0,1,0,1,0,0|1,0,1]=4 1026 B23R3.1995329 NC(c1ccccc1)c2ccccc2SC3CCCCC3 62a_100000210327_100011211563 [0,1,0,1,0,0|1,1,0]=4 1027 B23R3.1995329 NC(c1ccccc1)c2ccccc2SC3CCCCC3 62a_100011211563_100000210327 [0,1,0,1,0,0|1,1,0]=4 1028 B23R3.1995329 O=C(c1ccccc1Cc2ccccc2)C3CCCCC3 1458a_100000211042_100000210327 [0,1,0,1,0,0|2,0,0]=4 1029 B23R3.4258012 CCCCCCC(=O)c1cccc-2c1Cc3c2cccc3 1458a_100000033212_100000210757 [0,1,0,1,0,0|2,0,0]=4 1030 B23R3.1995321 NC(c1ccccc1)c2ccccc2SCC3CCCC3 62a_100000740388_100011211563 [0,1,0,1,0,0|1,1,0]=4 1031 B23R3.1995321 NC(c1ccccc1)c2ccccc2SCC3CCCC3 62a_100011211563_100000740388 [0,1,0,1,0,0|1,1,0]=4 1032 B23R4.5460 c1ccc2c(c1)oc3c2cccc3OC4CCCCC4 34a_100010256078_100000210327 [0,0,0,2,0,0|2,0,0]=4 1033 B23R4.5460 c1ccc2c(c1)oc3c2cccc3OC4CCCCC4 7a_100010256078_100000210327 [0,0,0,2,0,0|2,0,0]=4 1034 B23R4.1517178 c1ccc2c(c1)oc3c2cccc3OCC4CCCC4 34a_100010256078_100000740388 [0,0,0,2,0,0|2,0,0]=4 1035 B23R4.1517178 c1ccc2c(c1)oc3c2cccc3OCC4CCCC4 7a_100010256078_100000740388 [0,0,0,2,0,0|2,0,0]=4 1036 B19R2.127 CCCCC=Cc1ccccc1c2ccccc2 271570a_100016275911_100000033479 [1,0,0,0,1,0|1,0,1]=4 1037 B19R2.127 CCCCCSc1ccccc1c2ccccc2 62a_100000033479_100000210326 [1,0,0,0,1,0|0,1,0]=3 1038 B19R2.127 CCCCCSc1ccccc1c2ccccc2 62a_100000210326_100000033479 [1,0,0,0,1,0|0,1,0]=3 1039 B19R2.127 CCCCCSc1ccccc1c2ccccn2 62a_100000210326_100010202516 [1,0,0,0,1,0|1,1,0]=4 1040 B19R2.127 CCCCCSc1ccccc1c2ccccn2 62a_100010202516_100000210326 [1,0,0,0,1,0|1,1,0]=4 1041 B19R2.127 CCCCCSc1ccccc1c2ccncc2 62a_100000210326_100010154595 [1,0,0,0,1,0|1,1,0]=4 1042 B19R2.127 CCCCCSc1ccccc1c2ccncc2 62a_100010154595_100000210326 [1,0,0,0,1,0|1,1,0]=4 1043 B19R2.127 CCCCCSc1cccnc1c2ccccc2 62a_100000210326_100010138707 [1,0,0,0,1,0|1,1,0]=4 1044 B19R2.127 CCCCCSc1cccnc1c2ccccc2 62a_100010138707_100000210326 [1,0,0,0,1,0|1,1,0]=4 1045 B19R2.127 CCCCCSc1cnccc1c2ccccc2 62a_100000210326_100009816686 [1,0,0,0,1,0|1,1,0]=4 1046 B19R2.127 CCCCCSc1cnccc1c2ccccc2 62a_100009816686_100000210326 [1,0,0,0,1,0|1,1,0]=4 1047 B19R2.127 CCCCSCc1ccccc1c2ccccc2 271570a_100011218836_200011870348 [1,0,0,0,1,0|2,0,0]=4 1048 B19R2.127 CCCCSCc1ccccc1c2ccccc2 62a_100000210211_100009813379 [1,0,0,0,1,0|2,0,0]=4 1049 B19R2.127 CCCCSCc1ccccc1c2ccccc2 62a_100009813379_100000210210 [1,0,0,0,1,0|2,0,0]=4 1050 B19R2.127 CCSCCSc1ccccc1c2ccccc2 62a_100000033479_100000757381 [1,0,0,0,1,0|1,1,0]=4 1051 B19R2.127 CCSCCSc1ccccc1c2ccccc2 62a_100000757381_100000033479 [1,0,0,0,1,0|1,1,0]=4 1052 B19R2.127 FCCCCSc1ccccc1c2ccccc2 62a_100000033479_100000729493 [1,0,0,0,1,0|1,1,0]=4 1053 B19R2.127 FCCCCSc1ccccc1c2ccccc2 62a_100000729493_100000033479 [1,0,0,0,1,0|1,1,0]=4 1054 B19R2.1141 CCCCCCOc1ccccc1c2ccsc2 34a_100011997965_100000210314 [0,0,0,0,2,0|2,0,0]=4 1055 B19R2.1141 CCCCCCOc1ccccc1c2ccsc2 7a_100011997965_100000210314 [0,0,0,0,2,0|2,0,0]=4 1056 B21R2.2593 C=CCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100011215482 [0,0,0,0,1,1|1,0,1]=4 1057 B21R2.2593 C=CCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100011215482 [0,0,0,0,1,1|1,0,1]=4 1058 B21R2.2593 CCCCCCNc1cccc(c1)Cc2ccccc2 2230a_200000043086_100000210314 [0,0,0,0,1,1|2,0,0]=4 1059 B21R2.2593 CCCCCCNc1cccc(c1)Cc2ccccc2 34a_200000043086_100000210314 [0,0,0,0,1,1|2,0,0]=4 1060 B21R2.2593 CCCCCCNc1cccc(c1)Cc2ccccc2 7a_200000043086_100000210314 [0,0,0,0,1,1|2,0,0]=4 1061 B21R2.2593 CCCCCCOc1cccc(c1)Cc2ccccc2 34a_100000073777_100000210314 [0,0,0,0,1,1|1,0,0]=3 1062 B21R2.2593 CCCCCCOc1cccc(c1)Cc2ccccc2 7a_100000073777_100000210314 [0,0,0,0,1,1|1,0,0]=3 1063 B21R2.2593 CCCCCCOc1cccc(c1)Nc2ccccc2 34a_100000031534_100000210314 [0,0,0,0,1,1|2,0,0]=4 1064 B21R2.2593 CCCCCCOc1cccc(c1)Nc2ccccc2 7a_100000031534_100000210314 [0,0,0,0,1,1|2,0,0]=4 1065 B21R2.2593 CCCCCCOc1cccc(c1)Oc2ccccc2 7a_100000199087_100000210314 [0,0,0,0,1,1|2,0,0]=4 1066 B23R2.925206 CCCCCCOc1ccccc1C=NNc2ccccc2 4a_100015195140_200000189357 [0,0,0,0,0,2|1,0,1]=4 1067 B23R2.925206 CCCCCCSc1ccccc1CNCc2ccccc2 62a_100000210314_200000195884 [0,0,0,0,0,2|1,1,0]=4 1068 B23R2.925206 CCCCCCSc1ccccc1CNCc2ccccc2 62a_200000195884_100000210757 [0,0,0,0,0,2|1,1,0]=4