0 B22R3.239180 Brc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 ea2925ad389d4dbc1b2a717ce2667042 [1,0,0,0,0,0|1,0,2]=4 1 B22R3.239180 Brc1cccc(c1)N(Cc2nnn[nH]2)c3ccccc3 7f6c5ed8256541cb7c654c61ec548d2a [1,0,0,0,0,0|3,0,0]=4 2 B22R3.239180 Cc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 0bbd6929c9bb1e8988a061a9c5130818 [1,0,0,0,0,0|1,0,2]=4 3 B22R3.239180 Clc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 8d7a1e9e7dd5519de82096e655a5da4a [1,0,0,0,0,0|1,0,2]=4 4 B22R3.239180 Fc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 9a48dbf93c423f2060f8c1de49caf4ce [1,0,0,0,0,0|1,0,2]=4 5 B22R3.1011534 Brc1ccc(cc1)N(CC2=CCCC2)c3ccccc3 94f9f23edcf59b852e148a45dc6a7ea1 [1,0,0,0,0,0|3,0,0]=4 6 B22R3.1011534 Brc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 73455e229a808fc352cb1b7dd558de6e [1,0,0,0,0,0|1,0,2]=4 7 B22R3.1011534 Brc1ccc(cc1)N(Cc2nnn[nH]2)c3ccccc3 e428f7b08d304f9a0b1296927d55f09a [1,0,0,0,0,0|3,0,0]=4 8 B22R3.1011534 Cc1ccc(cc1)N(CC2CCCC2)c3ccccc3 cfb3d74e0dfc9c164dcccf9516e89186 [1,0,0,0,0,0|2,0,1]=4 9 B22R3.1011534 Cc1ccc(cc1)N(CC2CCCO2)c3ccccc3 feb813df7d7d018f681da9724191f9ec [1,0,0,0,0,0|2,0,1]=4 10 B22R3.1011534 Cc1ccc(cc1)N(Cc2ccon2)c3ccccc3 829f2d8a0a08334a4e64191091736fc9 [1,0,0,0,0,0|2,0,1]=4 11 B22R3.1011534 Cc1ccc(cc1)N(Cc2cocn2)c3ccccc3 d97f84ac69fc37a465561eb318b4d409 [1,0,0,0,0,0|2,0,1]=4 12 B22R3.1011534 Cc1ccc(cc1)N(Cc2cscn2)c3ccccc3 5b880c132f35cfd4f0c3f743ad0f3146 [1,0,0,0,0,0|2,0,1]=4 13 B22R3.1011534 Cc1ccc(cc1)N(Cc2nc[nH]n2)c3ccccc3 aceef29429624b31423295c853a3373b [1,0,0,0,0,0|1,0,2]=4 14 B22R3.1011534 Cc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 aa8136c3e6a1fd6dbbd080ca515f5e75 [1,0,0,0,0,0|0,0,2]=3 15 B22R3.1011534 Cc1ccc(cc1)N(Cc2ncco2)c3ccccc3 d54057b0dc7496e66a9a62bfed3dee26 [1,0,0,0,0,0|1,0,2]=4 16 B22R3.1011534 Cc1ccc(cc1)N(Cc2nccs2)c3ccccc3 a4fc75bfa716ac486983dec4213c015a [1,0,0,0,0,0|1,0,2]=4 17 B22R3.1011534 Cc1ccc(cc1)N(Cc2ncon2)c3ccccc3 add64a8c0967969d143311c3760df50f [1,0,0,0,0,0|1,0,2]=4 18 B22R3.1011534 Clc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 3b6b814f4d9a02b13d3c5d7ac69a0fec [1,0,0,0,0,0|1,0,2]=4 19 B22R3.1011534 Fc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 23be6aab68e13c9d5894dd49ecff0f4e [1,0,0,0,0,0|1,0,2]=4 20 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2cc(ccn2)O 18cd20e34b6c2ebf7157ce148ed997bc [0,0,1,0,0,0|3,0,0]=4 21 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)C ed301222d12980ee2ca32b0e690bd9cf [0,0,1,0,0,0|3,0,0]=4 22 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)F 77003f0f9d01c507813d9a5135089491 [0,0,1,0,0,0|3,0,0]=4 23 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)O 9fdbcf8027812f981afadf9f92fc65bc [0,0,1,0,0,0|2,0,0]=3 24 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)S 33096ac3a13fb7ddc4ce7b5bae77bfc2 [0,0,1,0,0,0|2,1,0]=4 25 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)C)c2ccnc(c2)O 9dd00dd3a2c84121aa769ed119f1f2b6 [0,0,1,0,0,0|3,0,0]=4 26 B22R2.468578 CCOC(=O)CN(c1ccc(cc1)F)c2cccc(c2)O aa53ea13c964f9e5296de891af819483 [0,0,1,0,0,0|3,0,0]=4 27 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3c[nH]cn3 5c7c3c0a339483647ecee7a0766cc89a [0,0,0,0,1,0|2,0,1]=4 28 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3c[nH]nn3 1bc64aaec5850978aac1fd48f4dde00a [0,0,0,0,1,0|3,0,0]=4 29 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3cc[nH]n3 a9821dfc18330dcf2ffb262d3440408c [0,0,0,0,1,0|2,0,1]=4 30 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ccon3 105c421913b88642785ce73c7a604b95 [0,0,0,0,1,0|2,0,1]=4 31 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ccsn3 875d72f4ec9bcb35f78d21a95be54a85 [0,0,0,0,1,0|2,0,1]=4 32 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3cnsn3 5f9fafdc71d4ca62b9ed4fe38a0a1b08 [0,0,0,0,1,0|3,0,0]=4 33 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3cocn3 5aed9d5abe75a2ab997b610eef03c070 [0,0,0,0,1,0|2,0,1]=4 34 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3cscn3 a3a96389d890814fda3ad6569252c4d7 [0,0,0,0,1,0|2,0,1]=4 35 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3csnn3 4f552f557538c2e2888b7fb32d406726 [0,0,0,0,1,0|3,0,0]=4 36 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3nc[nH]n3 b13008a0579a881d7ffba187b7adc04c [0,0,0,0,1,0|1,0,2]=4 37 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncc[nH]3 295a0113ec6dada24ac973d31bfa01e3 [0,0,0,0,1,0|0,0,2]=3 38 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncco3 e28cc787c1e9473c632ab0077d622767 [0,0,0,0,1,0|1,0,2]=4 39 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3nccs3 968f0c82ccde0dd6e2096236c47289c2 [0,0,0,0,1,0|1,0,2]=4 40 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncns3 1bbbe6310f96ccb4ab29d0923d8c235b [0,0,0,0,1,0|2,0,1]=4 41 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncsn3 c3896cee0c14a101118c3274bf912812 [0,0,0,0,1,0|1,0,2]=4 42 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3nn[nH]n3 5f4a9e9ad98d71a20841d23086d15da4 [0,0,0,0,1,0|2,0,1]=4 43 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3nnco3 b36289a8e114617f5216699c64607dc2 [0,0,0,0,1,0|2,0,1]=4 44 B22R3.1033395 Cc1ccc(cc1)N(c2cccc(c2)O)c3nncs3 599cfddc35b9e1b223b4830c3b128864 [0,0,0,0,1,0|2,0,1]=4 45 B21R2.4194 CCC/C=C/CN(c1ccccc1)c2ccc(cc2)C 43def58c6a6c07dbdcabecaaa0d331a5 [1,0,1,0,0,0|2,0,0]=4 46 B21R2.4194 CCC/C=C\CN(c1ccccc1)c2ccc(cc2)C 5ffab1362aee3306ef1438be039262cd [1,0,1,0,0,0|2,0,0]=4 47 B21R2.384393 COC(=O)CN(c1ccc(cc1)C)c2cccc(c2)O 90ce045cde98796fef9e24d7d8fe1f4d [1,0,1,0,0,0|2,0,0]=4 48 B21R2.17859 CCNC(=O)CN(c1ccccc1)c2cccc(c2)Br ef54eebf46262f090c589487493b61ac [1,0,1,0,0,0|2,0,0]=4 49 B21R2.17859 CCNC(=O)CN(c1ccccc1)c2cccc(c2)C da017725d78440dd043e6e4e90b0adc8 [1,0,1,0,0,0|2,0,0]=4 50 B21R2.17859 CCNC(=O)CN(c1ccccc1)c2cccc(c2)Cl 7f367d0ac81b67f97c93c705bb416d93 [1,0,1,0,0,0|2,0,0]=4 51 B21R2.17859 CCNC(=O)CN(c1ccccc1)c2cccc(c2)F 0b22b41fb74aaf05fd9f1358cb110853 [1,0,1,0,0,0|2,0,0]=4 52 B21R2.17862 CCCC(=O)CN(c1ccccc1)c2ccc(cc2)C c89f5106eb5c95f39babb80210f08f67 [1,0,1,0,0,0|2,0,0]=4 53 B21R2.17862 CCNC(=O)CN(c1ccccc1)c2ccc(cc2)Br 9c4e7044a140f480b82b9071fbd191d8 [1,0,1,0,0,0|2,0,0]=4 54 B21R2.17862 CCNC(=O)CN(c1ccccc1)c2ccc(cc2)C fddfcf5cc7c0046ec4baf93e7c12e59d [1,0,1,0,0,0|1,0,0]=3 55 B21R2.17862 CCNC(=O)CN(c1ccccc1)c2ccc(cc2)Cl 0b0557677ae369a37c1b20a23cc781fd [1,0,1,0,0,0|2,0,0]=4 56 B21R2.17862 CCNC(=O)CN(c1ccccc1)c2ccc(cc2)F 494081f2d85953ed22ebdf392dea0fdb [1,0,1,0,0,0|2,0,0]=4 57 B21R2.17862 CCOC(=O)CN(c1ccccc1)c2ccc(cc2)C ae27734d1a840a927eb6e551c65e3ae3 [1,0,1,0,0,0|2,0,0]=4 58 B21R2.17862 Cc1ccc(cc1)N(CC(=O)NCO)c2ccccc2 46d52d6b698fb99c44326f3a1e669f1a [1,0,1,0,0,0|2,0,0]=4 59 B21R3.47836 c1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 8f301afcb59074949dde9b2b85e15493 [2,0,0,0,0,0|0,0,2]=4 60 B23R2.649871 CCOC(=O)CN(c1ccc(cc1)OC)c2cccc(c2)O 37396777c9cefb8bfb19d47969d7bacb [0,1,1,0,0,0|2,0,0]=4 61 B23R2.10740410 CCOC(=O)CN(c1ccc(cc1)C)c2cc(ccc2C)O 85af49f0a72573932679cbcc71906476 [0,1,1,0,0,0|2,0,0]=4 62 B23R2.10740410 CCOC(=O)CN(c1ccc(cc1)C)c2cc(ccc2F)O a0b9dba671dc71850ee2c33898c7da33 [0,1,1,0,0,0|2,0,0]=4 63 B23R2.10740417 CCOC(=O)CN(c1ccc(cc1)C)c2ccc(c(c2)O)C d2bcb350baf01d793a9e9c73008316dd [0,1,1,0,0,0|2,0,0]=4 64 B23R2.10740417 CCOC(=O)CN(c1ccc(cc1)C)c2ccc(c(c2)O)F 15559dbbb90b67aa420c63213a430c3e [0,1,1,0,0,0|2,0,0]=4 65 B23R2.10740417 CCOC(=O)CN(c1ccc(cc1)C)c2ccc(c(c2)O)O b0c6e4ea712a33388e592366ad08063e [0,1,1,0,0,0|2,0,0]=4 66 B23R2.10740422 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2F)O a3c099c0857fe0a8371233d0a6e95691 [0,1,1,0,0,0|2,0,0]=4 67 B23R2.10740424 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)CO 69cdc7a9416b3d644df9e01de854d226 [0,1,1,0,0,0|2,0,0]=4 68 B23R2.10740424 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)OC f98fa6f51141af88e52fa71203f465ba [0,1,1,0,0,0|2,0,0]=4 69 B23R2.10740424 CCOC(=O)CN(c1ccc(cc1)C)c2cccc(c2)ON 6bab985c6d0e7625a8a0c12b9c395309 [0,1,1,0,0,0|2,0,0]=4 70 B23R2.288629913 CCOC(=O)CN(c1ccc(cc1)C)c2cc(cc(c2)F)O f31081afe2f4d1634de99dd5e5243be5 [0,1,1,0,0,0|2,0,0]=4 71 B23R2.288629913 CCOC(=O)CN(c1ccc(cc1)C)c2cc(cc(c2)O)C 296241030b9d58620755d0bbd99d10e3 [0,1,1,0,0,0|2,0,0]=4 72 B23R2.288629913 CCOC(=O)CN(c1ccc(cc1)C)c2cc(cc(c2)O)O 4ba27c2f907726ea03f7f0a2ad9fdf86 [0,1,1,0,0,0|2,0,0]=4 73 B23R3.2031670 COc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 fe5a2050d5898960222d3c143aa11f11 [1,1,0,0,0,0|0,0,2]=4 74 B23R3.2031670 COc1cccc(c1)N(Cc2nnn[nH]2)c3ccccc3 ba2ffa487eaefcaf718e0166deacec99 [1,1,0,0,0,0|2,0,0]=4 75 B23R3.2031670 OCc1cccc(c1)N(Cc2ncc[nH]2)c3ccccc3 887e0cffc4724197aedfd82ac67c0ede [1,1,0,0,0,0|0,0,2]=4 76 B23R3.2031670 OCc1cccc(c1)N(Cc2nnn[nH]2)c3ccccc3 4f4efee736feb517033029e506aaa15b [1,1,0,0,0,0|2,0,0]=4 77 B23R3.22370 COc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 b73ef7de17bfed007d42cbd5fea32b74 [1,1,0,0,0,0|0,0,2]=4 78 B23R3.22370 COc1ccc(cc1)N(Cc2nnn[nH]2)c3ccccc3 f023de1ea3776273c712f8ee93aa4db0 [1,1,0,0,0,0|2,0,0]=4 79 B23R3.22370 OCc1ccc(cc1)N(Cc2ncc[nH]2)c3ccccc3 a37112ef33ce853943dd154c7b97a703 [1,1,0,0,0,0|0,0,2]=4 80 B23R3.22370 OCc1ccc(cc1)N(Cc2nnn[nH]2)c3ccccc3 7e9837938466a607411e72c1f7f14044 [1,1,0,0,0,0|2,0,0]=4 81 B23R3.119857 Cc1ccc(cc1)N(Cc2ncc[nH]2)c3ccc(cc3)Br 9929bf24554755bf4df1226f51f548c7 [1,1,0,0,0,0|0,0,2]=4 82 B23R3.119857 Cc1ccc(cc1)N(Cc2ncc[nH]2)c3ccc(cc3)C e48d5f2fbe00fd251d292fde10441329 [1,1,0,0,0,0|0,0,2]=4 83 B23R3.119857 Cc1ccc(cc1)N(Cc2nnn[nH]2)c3ccc(cc3)C ee0ba96194b8a3a768f5e0ebafb58c44 [1,1,0,0,0,0|2,0,0]=4 84 B23R3.119897 Cc1ccc(cc1)N(Cc2nccn2C)c3ccccc3 785b34fd76dd2623787a48d2ff1f23a9 [1,1,0,0,0,0|0,0,2]=4 85 B23R3.8363117 Cc1ccc(c(c1)C)N(Cc2ncc[nH]2)c3ccccc3 508eee6fc43c0acd288162d4a3fccf6e [1,1,0,0,0,0|0,0,2]=4 86 B23R3.1339446 Cc1ccc(cc1)N(c2cccc(c2)O)c3nccn3C f0439f952e8fec892db30fbb26271eff [0,1,0,0,1,0|0,0,2]=4 87 B23R3.1339446 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncnn3C ed4133df32163c80273522ba83b1cbf9 [0,1,0,0,1,0|1,0,1]=4 88 B23R3.1339446 Cc1ccc(cc1)N(c2cccc(c2)O)c3nncn3C e0a7227cfc9758ed99034ab20be2ea87 [0,1,0,0,1,0|1,0,1]=4 89 B23R3.1339446 Cc1ccc(cc1)N(c2cccc(c2)O)c3nnnn3C 9f330b77460d820bfad2e210dfae1374 [0,1,0,0,1,0|2,0,0]=4 90 B23R3.1339447 Cc1ccc(cc1)N(c2cccc(c2)O)c3ncc([nH]3)C c49497272692d06adf80ada813ea4b3a [0,1,0,0,1,0|0,0,2]=4 91 B25R3.2814621 COc1ccc(cc1)N(Cc2ncc[nH]2)c3cccc(c3)OC ae79f9ec27c041d3ea80772fbc505400 [0,2,0,0,0,0|0,0,2]=4 92 B25R3.2814621 COc1ccc(cc1)N(Cc2nnn[nH]2)c3cccc(c3)OC f5f1cf01496e968f3ff95f4d292fc6ce [0,2,0,0,0,0|2,0,0]=4 93 B21R3.649734 Cc1ccc(cc1)N(CC2CCC2)c3ccccc3 e670d40559d97fb00d364508b939fc39 [1,0,0,0,1,0|1,0,1]=4 94 B21R3.649734 Cc1ccc(cc1)N(CC2CCO2)c3ccccc3 a9f3f6c5b0d8db76233ad0d22db35db9 [1,0,0,0,1,0|1,0,1]=4 95 B21R3.649734 Cc1ccc(cc1)N(C[C@H]2CCO2)c3ccccc3 0e4c696bbeadc561a80bf52e1426f659 [1,0,0,0,1,0|1,0,1]=4 96 B21R3.661824 Cc1ccc(cc1)N(c2cccc(c2)O)C3CCC3 463173b02ef3f5f977471feaac8acfeb [0,0,0,0,2,0|1,0,1]=4 97 B23R3.68583 Cc1ccc(cc1)N(Cc2ccccc2)Cc3ncc[nH]3 d5aa23f87e26da57b55168dfca8a7cf4 [1,0,0,0,0,1|0,0,2]=4 98 B23R3.68583 Cc1ccc(cc1)N(Cc2ccccc2)Cc3nnn[nH]3 ab4b19fa663fe41423e3ec5e9f991ec1 [1,0,0,0,0,1|2,0,0]=4