0 B22R3.12374534 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_200000210301 [0,0,0,0,0,0|0,0,0]=0 1 B22R3.12374534 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)[13CH3] 269982a_100116208926_200025704644 [0,0,0,0,0,0|0,0,0]=0 2 B23R3.25116865 CCN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100000204670 [0,1,0,0,0,0|0,0,0]=1 3 B23R3.25116865 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)CF 269982a_100116208926_100015361967 [0,1,0,0,0,0|0,0,0]=1 4 B21R2.4288 Cc1cc(ccc1Sc2ccc(cc2)N(C)C)N(C)C 62a_100000210421_100011934168 [0,0,1,0,0,0|2,0,0]=3 5 B21R2.4288 Cc1cc(ccc1Sc2ccc(cc2)N(C)C)N(C)C 62a_100011934168_100000210421 [0,0,1,0,0,0|2,0,0]=3 6 B21R2.4288 Cc1cc(ccc1Sc2ccc(cn2)N(C)C)N(C)C 62a_100009992925_100011934168 [0,0,1,0,0,0|3,0,0]=4 7 B21R2.4288 Cc1cc(ccc1Sc2ccc(cn2)N(C)C)N(C)C 62a_100011934168_100009992925 [0,0,1,0,0,0|3,0,0]=4 8 B21R2.4288 Cc1cc(ccc1Sc2ccc(nc2)N(C)C)N(C)C 62a_100011465347_100011934168 [0,0,1,0,0,0|3,0,0]=4 9 B21R2.4288 Cc1cc(ccc1Sc2ccc(nc2)N(C)C)N(C)C 62a_100011934168_100011465347 [0,0,1,0,0,0|3,0,0]=4 10 B21R2.19076 CC(C)c1ccc(c(c1)Sc2cccc(c2)N(C)C)N 62a_100011215952_100011218581 [0,0,1,0,0,0|1,0,2]=4 11 B21R2.19076 CC(C)c1ccc(c(c1)Sc2cccc(c2)N(C)C)N 62a_100011218581_100011215952 [0,0,1,0,0,0|1,0,2]=4 12 B21R2.19076 CC(C)c1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_100011214899_200013039233 [0,0,1,0,0,0|1,0,2]=4 13 B21R2.19076 CC(C)c1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_200013039233_100011214899 [0,0,1,0,0,0|1,0,2]=4 14 B21R2.19076 CN(C)c1ccc(c(c1)Sc2cccc(n2)N(C)C)N 62a_100011960435_200013039233 [0,0,1,0,0,0|1,0,2]=4 15 B21R2.19076 CN(C)c1ccc(c(c1)Sc2cccc(n2)N(C)C)N 62a_200013039233_100011960435 [0,0,1,0,0,0|1,0,2]=4 16 B21R2.19076 CN(C)c1ccc(c(c1)Sc2ccnc(c2)N(C)C)N 62a_100012361627_200013039233 [0,0,1,0,0,0|1,0,2]=4 17 B21R2.19076 CN(C)c1ccc(c(c1)Sc2ccnc(c2)N(C)C)N 62a_200013039233_100012361627 [0,0,1,0,0,0|1,0,2]=4 18 B21R2.19076 CN(C)c1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_100011215952_200013039233 [0,0,1,0,0,0|0,0,2]=3 19 B21R2.19076 CN(C)c1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_200013039233_100011215952 [0,0,1,0,0,0|0,0,2]=3 20 B21R2.19076 CN(C)c1ccnc(c1)Sc2cc(ccc2N)N(C)C 62a_100000766659_200013039233 [0,0,1,0,0,0|1,0,2]=4 21 B21R2.19076 CN(C)c1ccnc(c1)Sc2cc(ccc2N)N(C)C 62a_200013039233_100000766659 [0,0,1,0,0,0|1,0,2]=4 22 B21R2.19076 CN(C)c1cncc(c1)Sc2cc(ccc2N)N(C)C 62a_100012350714_200013039233 [0,0,1,0,0,0|1,0,2]=4 23 B21R2.19076 CN(C)c1cncc(c1)Sc2cc(ccc2N)N(C)C 62a_200013039233_100012350714 [0,0,1,0,0,0|1,0,2]=4 24 B23R3.26177640 CC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 11a_100015190831_100015343762 [0,0,0,0,0,1|2,0,0]=3 25 B23R3.26177640 CC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 1626a_100015190831_100015343762 [0,0,0,0,0,1|2,0,0]=3 26 B23R3.26177640 CC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 22a_100015190831_100000070787 [0,0,0,0,0,1|2,0,0]=3 27 B22R2.5812906 Cc1cc(ccc1Sc2ccc(c(c2)N)N(C)C)N(C)C 62a_100000737018_100011934168 [0,1,1,0,0,0|2,0,0]=4 28 B22R2.5812906 Cc1cc(ccc1Sc2ccc(c(c2)N)N(C)C)N(C)C 62a_100011934168_100000737018 [0,1,1,0,0,0|2,0,0]=4 29 B22R2.5814578 Cc1cc(ccc1Sc2ccc(cc2C)N(C)C)N(C)C 62a_100011934168_100011934168 [0,1,1,0,0,0|2,0,0]=4 30 B22R2.5877633 Cc1cc(cc(c1Sc2ccc(cc2)N(C)C)C)N(C)C 62a_100000210421_100011935182 [0,1,1,0,0,0|2,0,0]=4 31 B22R2.5877633 Cc1cc(cc(c1Sc2ccc(cc2)N(C)C)C)N(C)C 62a_100011935182_100000210421 [0,1,1,0,0,0|2,0,0]=4 32 B22R2.521247 CN(C)c1ccc(c(c1)Sc2cc(ccc2N)N(C)C)N 62a_200013039233_200013039233 [0,1,1,0,0,0|0,0,2]=4 33 B22R2.521340 CN(C)c1ccc(c(c1)Sc2ccc(c(c2)N(C)C)F)N 62a_100010288836_200013039233 [0,1,1,0,0,0|0,0,2]=4 34 B22R2.521340 CN(C)c1ccc(c(c1)Sc2ccc(c(c2)N(C)C)F)N 62a_200013039233_100010288836 [0,1,1,0,0,0|0,0,2]=4 35 B24R3.141277 CC(=O)Nc1cc2[s+]c3cc(ccc3nc2cc1C)N(C)C 11a_100016998905_100015343762 [0,1,0,0,0,1|2,0,0]=4 36 B24R3.141277 CC(=O)Nc1cc2[s+]c3cc(ccc3nc2cc1C)N(C)C 1626a_100016998905_100015343762 [0,1,0,0,0,1|2,0,0]=4 37 B24R3.141277 CC(=O)Nc1cc2[s+]c3cc(ccc3nc2cc1C)N(C)C 22a_100016998905_100000070787 [0,1,0,0,0,1|2,0,0]=4 38 B24R3.28671921 CC(=O)N(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 11a_100116208926_100015343762 [0,1,0,0,0,1|2,0,0]=4 39 B24R3.28671921 CC(=O)N(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 1626a_100116208926_100015343762 [0,1,0,0,0,1|2,0,0]=4 40 B24R3.28671921 CC(C)N(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100000210206 [0,1,0,0,0,1|1,0,0]=3 41 B24R3.62243417 CCC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 11a_100015190831_100000210414 [0,1,0,0,0,1|2,0,0]=4 42 B24R3.62243417 CCC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 1626a_100015190831_100000210414 [0,1,0,0,0,1|2,0,0]=4 43 B24R3.62243417 CCC(=O)Nc1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 22a_100015190831_100000210414 [0,1,0,0,0,1|2,0,0]=4 44 B24R3.62243417 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)NC(=O)CO 22a_100015190831_100000210174 [0,1,0,0,0,1|2,0,0]=4 45 B24R3.246928298 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)NS(=O)(=O)C 40a_100015190831_100000738038 [0,1,0,0,0,1|2,0,0]=4 46 B24R3.32397265 C=CCN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100000210623 [0,2,0,0,0,0|0,0,0]=2 47 B24R3.32397265 CCCN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100000210303 [0,2,0,0,0,0|0,0,0]=2 48 B24R3.32397265 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)CC#N 269982a_100116208926_100011214920 [0,2,0,0,0,0|0,0,0]=2 49 B24R3.32397265 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)CC=O 269982a_100116208926_200015260668 [0,2,0,0,0,0|0,0,0]=2 50 B24R3.32397265 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)CCF 269982a_100116208926_100011217306 [0,2,0,0,0,0|0,0,0]=2 51 B24R3.32397265 CN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)CCO 269982a_100116208926_100000211926 [0,2,0,0,0,0|0,0,0]=2 52 B24R3.32397265 COCN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100000766300 [0,2,0,0,0,0|0,0,0]=2 53 B24R3.32397265 CSCN(C)c1ccc2nc3ccc(cc3[s+]c2c1)N(C)C 269982a_100116208926_100011218213 [0,2,0,0,0,0|0,0,0]=2 54 B22R2.4142 Cc1cc(ccc1Sc2ccc(cc2)CN(C)C)N(C)C 62a_100000174694_100011934168 [0,0,1,0,0,1|2,0,0]=4 55 B22R2.4142 Cc1cc(ccc1Sc2ccc(cc2)CN(C)C)N(C)C 62a_100011934168_100000174694 [0,0,1,0,0,1|2,0,0]=4 56 B22R2.283330 CN(C)c1ccc(cc1)CNc2ccc(cc2Br)N(C)C 270302a_200013039233_100000185837 [0,0,1,0,0,1|1,0,1]=4 57 B22R2.283330 CN(C)c1ccc(cc1)NCc2ccc(cc2Cl)N(C)C 270302a_100016997997_100011219522 [0,0,1,0,0,1|1,0,1]=4 58 B22R2.283330 Cc1cc(ccc1CNc2ccc(cc2)N(C)C)N(C)C 270302a_100016997997_100011615803 [0,0,1,0,0,1|1,0,1]=4 59 B22R2.283330 Cc1cc(ccc1NCc2ccc(cc2)N(C)C)N(C)C 207a_100000246174_100000185837 [0,0,1,0,0,1|1,0,1]=4 60 B22R2.283330 Cc1cc(ccc1NCc2ccc(cc2)N(C)C)N(C)C 270302a_100000246174_100000185837 [0,0,1,0,0,1|1,0,1]=4 61 B22R2.22670 Cc1ccc(cc1NCc2cccc(c2)N(C)C)N(C)C 207a_100015186894_100011794417 [0,0,1,0,0,1|2,0,0]=4 62 B22R2.22670 Cc1ccc(cc1NCc2cccc(c2)N(C)C)N(C)C 270302a_100015186894_100011794417 [0,0,1,0,0,1|2,0,0]=4 63 B22R2.22693 CN(C)Cc1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_100000174759_200013039233 [0,0,1,0,0,1|0,0,2]=4 64 B22R2.22693 CN(C)Cc1cccc(c1)Sc2cc(ccc2N)N(C)C 62a_200013039233_100000174759 [0,0,1,0,0,1|0,0,2]=4