0 B28R4.537217072 O=C(CN1C(=O)c2ccccc2C1=O)c3ccc4c(c3)OCCCO4 1458a_100000198587_100000211781 [1,0,0,0,0,0|1,0,0]=2 1 B28R3.5968628 O=C(NNC(=O)c1ccccc1[N+](=O)[O-])c2ccc3c(c2)OCCCO3 22a_100000187933_100000198587 [0,0,1,0,0,0|2,0,1]=4 2 B30R4.425841522 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 11a_100000181267_100000186633 [0,0,0,0,0,1|0,0,0]=1 3 B30R4.425841522 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 1626a_100000181267_100000186633 [0,0,0,0,0,1|0,0,0]=1 4 B30R4.425841522 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 22a_100000181267_100000186633 [0,0,0,0,0,1|0,0,0]=1 5 B30R4.425841522 O=C(Cc1ccc2c(c1)OCCCO2)CN3C(=O)c4ccccc4S3(=O)=O 1458a_100000186633_100000742768 [0,0,0,0,0,1|0,0,0]=1 6 B27R3.11897137 CCCOc1ccc(cc1Cl)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_100000217228_100000211781 [1,0,1,0,0,0|2,0,0]=4 7 B27R3.45075672 CCOc1cc(ccc1OC)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_100000181421_100000211781 [1,0,1,0,0,0|1,0,0]=3 8 B27R3.45915104 CCCCOc1ccc(cc1)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_100000182901_100000211781 [1,0,1,0,0,0|2,0,0]=4 9 B27R3.63437549 CCCOc1cc(ccc1Cl)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_200010157554_100000211781 [1,0,1,0,0,0|2,0,0]=4 10 B27R3.76331812 CCCCOc1cccc(c1)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_100000216332_100000211781 [1,0,1,0,0,0|2,0,0]=4 11 B27R3.304706859 CCOc1ccc(cc1OC)C(=O)CN2C(=O)c3ccccc3C2=O 1458a_100000184834_100000211781 [1,0,1,0,0,0|1,0,0]=3 12 B27R4.111822903 O=C1c2ccccc2C(=O)N1CNc3ccc4c(c3)OCCCO4 2230a_100000181267_100000211781 [2,0,0,0,0,0|2,0,0]=4 13 B27R4.111822903 O=C1c2ccccc2C(=O)N1CSc3ccc4c(c3)OCCCO4 62a_100000211781_100000739260 [2,0,0,0,0,0|2,0,0]=4 14 B27R4.111822903 O=C1c2ccccc2C(=O)N1CSc3ccc4c(c3)OCCCO4 62a_100000739260_100000211781 [2,0,0,0,0,0|2,0,0]=4 15 B31R4.2542531619 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3cc4c(cc3Cl)OCCCO4 11a_200000234880_100000186633 [0,1,0,0,0,1|0,0,0]=2 16 B31R4.2542531619 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3cc4c(cc3Cl)OCCCO4 1626a_200000234880_100000186633 [0,1,0,0,0,1|0,0,0]=2 17 B31R4.2542531619 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3cc4c(cc3Cl)OCCCO4 22a_200000234880_100000186633 [0,1,0,0,0,1|0,0,0]=2 18 B27R2.11712863 CCOc1ccc(cc1OC)C(=O)NNC(=O)c2ccccc2I(=O)=O 22a_100000184587_100000061294 [0,0,2,0,0,0|2,0,0]=4 19 B27R3.43156755 CS(=O)c1ccccc1C(=O)CC(=O)c2ccc3c(c2)OCCCO3 1458a_100000204632_100000205144 [0,0,1,0,1,0|1,0,1]=4 20 B27R3.43156755 O=C(CC(=O)c1ccccc1I(=O)=O)c2ccc3c(c2)OCCCO3 1458a_100000061294_100000205144 [0,0,1,0,1,0|1,0,0]=3 21 B27R3.43156755 O=C(CC(=O)c1ccccc1[N+](=O)[O-])c2ccc3c(c2)OCCCO3 1458a_100000188706_100000205144 [0,0,1,0,1,0|1,0,1]=4 22 B27R3.43156755 O=C(CC(=O)c1ccccc1[N+](=O)[O-])c2ccc3c(c2)OCCCO3 1458a_100000198587_100011219728 [0,0,1,0,1,0|1,0,1]=4 23 B27R3.67851032 COc1ccccc1S(=O)(=O)NC(=O)c2ccc3c(c2)OCCCO3 2740a_100000164555_100000198587 [0,0,1,0,1,0|2,0,0]=4 24 B27R3.67851032 N#Cc1ccccc1S(=O)(=O)NC(=O)c2ccc3c(c2)OCCCO3 2740a_100000164571_100000198587 [0,0,1,0,1,0|1,0,1]=4 25 B27R4.111815709 O=C(CN1C(=O)c2ccccc2C1=O)c3ccc4c(c3)CCCC4 1458a_100000199106_100000211781 [1,0,0,0,1,0|2,0,0]=4 26 B27R4.111815709 O=C(CN1C(=O)c2ccccc2C1=O)c3ccc4c(c3)CCCO4 1458a_100011398765_100000211781 [1,0,0,0,1,0|1,0,0]=3 27 B27R4.111815709 O=C(CN1C(=O)c2ccccc2C1=O)c3ccc4c(c3)OCCO4 1458a_100000182659_100000211781 [1,0,0,0,1,0|1,0,0]=3 28 B29R3.22332322 CCCOc1ccc(cc1Cl)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000742593_100000186633 [0,0,1,0,0,1|1,0,0]=3 29 B29R3.22332322 CCCOc1ccc(cc1Cl)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000742593_100000186633 [0,0,1,0,0,1|1,0,0]=3 30 B29R3.22332322 CCCOc1ccc(cc1Cl)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000742593_100000186633 [0,0,1,0,0,1|1,0,0]=3 31 B29R3.97499989 CCCCCc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000211775_100000186633 [0,0,1,0,0,1|2,0,0]=4 32 B29R3.97499989 CCCCCc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000211775_100000186633 [0,0,1,0,0,1|2,0,0]=4 33 B29R3.97499989 CCCCCc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000211775_100000186633 [0,0,1,0,0,1|2,0,0]=4 34 B29R3.97499989 CCCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100011194258_100000186633 [0,0,1,0,0,1|1,0,0]=3 35 B29R3.97499989 CCCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100011194258_100000186633 [0,0,1,0,0,1|1,0,0]=3 36 B29R3.97499989 CCCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100011194258_100000186633 [0,0,1,0,0,1|1,0,0]=3 37 B29R3.97499989 COCCOc1ccc(cc1)CC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1458a_100000186633_100011242488 [0,0,1,0,0,1|2,0,0]=4 38 B29R3.97499989 COCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000739146_100000186633 [0,0,1,0,0,1|2,0,0]=4 39 B29R3.97499989 COCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000739146_100000186633 [0,0,1,0,0,1|2,0,0]=4 40 B29R3.97499989 COCCOc1ccc(cc1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000739146_100000186633 [0,0,1,0,0,1|2,0,0]=4 41 B29R3.97499989 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc(cc3)OCCCO 22a_100000730458_100000186633 [0,0,1,0,0,1|0,0,0]=2 42 B29R3.143863621 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc(c(c3)OCCF)Cl 11a_200012813738_100000186633 [0,0,1,0,0,1|2,0,0]=4 43 B29R3.143863621 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc(c(c3)OCCF)Cl 1626a_200012813738_100000186633 [0,0,1,0,0,1|2,0,0]=4 44 B29R3.143863621 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc(c(c3)OCCF)Cl 22a_200012813738_100000186633 [0,0,1,0,0,1|2,0,0]=4 45 B29R3.170963621 CCCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000744072_100000186633 [0,0,1,0,0,1|1,0,0]=3 46 B29R3.170963621 CCCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000744072_100000186633 [0,0,1,0,0,1|1,0,0]=3 47 B29R3.170963621 CCCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000744072_100000186633 [0,0,1,0,0,1|1,0,0]=3 48 B29R3.170963621 COCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000742008_100000186633 [0,0,1,0,0,1|2,0,0]=4 49 B29R3.170963621 COCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000742008_100000186633 [0,0,1,0,0,1|2,0,0]=4 50 B29R3.170963621 COCCOc1cccc(c1)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000742008_100000186633 [0,0,1,0,0,1|2,0,0]=4 51 B29R3.577467782 CCOc1ccc(cc1OC)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 11a_100000184985_100000186633 [0,0,1,0,0,1|0,0,0]=2 52 B29R3.577467782 CCOc1ccc(cc1OC)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 1626a_100000184985_100000186633 [0,0,1,0,0,1|0,0,0]=2 53 B29R3.577467782 CCOc1ccc(cc1OC)NC(=O)CN2C(=O)c3ccccc3S2(=O)=O 22a_100000184985_100000186633 [0,0,1,0,0,1|0,0,0]=2 54 B29R4.1724500140 O=C(CCN1C(=O)c2ccccc2C1=O)c3ccc4c(c3)OCCCO4 1458a_100000198587_100000185391 [1,0,0,0,0,1|1,0,0]=3 55 B29R4.1724500140 O=C(CSC1C(=O)c2ccccc2C1=O)c3ccc4c(c3)OCCCO4 62a_100000205144_200009813996 [1,0,0,0,0,1|2,0,0]=4 56 B29R4.1724500140 O=C(CSC1C(=O)c2ccccc2C1=O)c3ccc4c(c3)OCCCO4 62a_200009813996_100000205144 [1,0,0,0,0,1|2,0,0]=4 57 B29R4.1724503490 C=C1c2ccccc2C(=O)N1CC(=O)Cc3ccc4c(c3)OCCCO4 1458a_100000240127_100000742768 [1,0,0,0,0,1|2,0,0]=4 58 B29R4.1724503490 C=C1c2ccccc2C(=O)N1CC(=O)Nc3ccc4c(c3)OCCCO4 11a_100000181267_100000240127 [1,0,0,0,0,1|2,0,0]=4 59 B29R4.1724503490 C=C1c2ccccc2C(=O)N1CC(=O)Nc3ccc4c(c3)OCCCO4 22a_100000181267_100000240127 [1,0,0,0,0,1|2,0,0]=4 60 B29R4.1724503490 C=C1c2ccccc2C(=O)N1CC(=O)Nc3ccc4c(c3)OCCCO4 527a_100000181267_100000240127 [1,0,0,0,0,1|2,0,0]=4 61 B29R4.1724503490 O=C(CN1C(=O)c2ccccc2C1=O)Nc3ccc4c(c3)OCCCO4 11a_100000181267_100000180889 [1,0,0,0,0,1|1,0,0]=3 62 B29R4.1724503490 O=C(CN1C(=O)c2ccccc2C1=O)Nc3ccc4c(c3)OCCCO4 1626a_100000181267_100000180889 [1,0,0,0,0,1|1,0,0]=3 63 B29R4.1724503490 O=C(CN1C(=O)c2ccccc2C1=O)Nc3ccc4c(c3)OCCCO4 22a_100000181267_100000180889 [1,0,0,0,0,1|1,0,0]=3 64 B29R4.1724503490 O=C(CN1C(=O)c2ccccc2C1=O)Nc3ccc4c(c3)OCCCO4 527a_100000181267_100000180889 [1,0,0,0,0,1|1,0,0]=3 65 B29R4.1724503490 O=C(CN1C(=O)c2cccnc2C1=O)Nc3ccc4c(c3)OCCCO4 11a_100000181267_100000750075 [1,0,0,0,0,1|2,0,0]=4 66 B29R4.1724503490 O=C(CN1C(=O)c2cccnc2C1=O)Nc3ccc4c(c3)OCCCO4 1626a_100000181267_100000750075 [1,0,0,0,0,1|2,0,0]=4 67 B29R4.1724503490 O=C(CN1C(=O)c2cccnc2C1=O)Nc3ccc4c(c3)OCCCO4 22a_100000181267_100000750075 [1,0,0,0,0,1|2,0,0]=4 68 B29R4.1724503490 O=C(Cc1ccc2c(c1)OCCCO2)CN3C(=O)c4ccccc4C3=O 1458a_100000180889_100000742768 [1,0,0,0,0,1|1,0,0]=3 69 B29R4.1724503490 O=C(Cc1ccc2c(c1)OCCCO2)CN3C(=O)c4cccnc4C3=O 1458a_100000750075_100000742768 [1,0,0,0,0,1|2,0,0]=4 70 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCC4 11a_100011205400_100000186633 [0,0,0,0,1,1|1,0,0]=3 71 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCC4 1626a_100011205400_100000186633 [0,0,0,0,1,1|1,0,0]=3 72 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCC4 22a_100011205400_100000186633 [0,0,0,0,1,1|1,0,0]=3 73 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCO4 11a_100138412508_100000186633 [0,0,0,0,1,1|0,0,0]=2 74 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCO4 1626a_100138412508_100000186633 [0,0,0,0,1,1|0,0,0]=2 75 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)CCCO4 22a_100138412508_100000186633 [0,0,0,0,1,1|0,0,0]=2 76 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCO4 11a_100020630400_100000186633 [0,0,0,0,1,1|0,0,0]=2 77 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCO4 1626a_100020630400_100000186633 [0,0,0,0,1,1|0,0,0]=2 78 B29R4.270026080 O=C(CN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCO4 22a_100020630400_100000186633 [0,0,0,0,1,1|0,0,0]=2 79 B31R4.1507434198 O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Cc3ccc4c(c3)OCCCO4 1458a_100000272006_100000742768 [0,0,0,0,0,2|0,0,0]=2 80 B31R4.1507434198 O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 11a_100000181267_100000272006 [0,0,0,0,0,2|0,0,0]=2 81 B31R4.1507434198 O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 1626a_100000181267_100000272006 [0,0,0,0,0,2|0,0,0]=2 82 B31R4.1507434198 O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 22a_100000181267_100000272006 [0,0,0,0,0,2|0,0,0]=2 83 B31R4.1507434198 O=C(CCN1C(=O)c2ccccc2S1(=O)=O)Nc3ccc4c(c3)OCCCO4 527a_100000181267_100000272006 [0,0,0,0,0,2|0,0,0]=2 84 B31R4.578827138 O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc3ccc4c(c3)OCCCO4 11a_100000750700_100000186633 [0,0,0,0,0,2|0,0,0]=2 85 B31R4.578827138 O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc3ccc4c(c3)OCCCO4 1626a_100000750700_100000186633 [0,0,0,0,0,2|0,0,0]=2 86 B31R4.578827138 O=C(CN1C(=O)c2ccccc2S1(=O)=O)NCc3ccc4c(c3)OCCCO4 240690a_100000750700_100000186633 [0,0,0,0,0,2|0,0,0]=2