0 B18R2.92911 CC(=O)N(Cc1ncco1)c2ccc(cc2)Br AIFCHEM-94685597465 [0,0,0,0,0,0|2,1,1]=4 1 B18R2.92911 CC(=O)N(Cc1ncco1)c2ccc(cc2)C AIFCHEM-99350747781 [0,0,0,0,0,0|3,0,1]=4 2 B18R2.92911 CC(=O)N(Cc1ncco1)c2ccc(cc2)O AIFCHEM-94685190330 [0,0,0,0,0,0|3,0,1]=4 3 B18R2.92911 CC(=O)N(Cc1nccs1)c2ccc(cc2)Br AIFCHEM-98287867172 [0,0,0,0,0,0|2,1,1]=4 4 B18R2.92911 CC(=O)N(Cc1nccs1)c2ccc(cc2)C AIFCHEM-98288410323 [0,0,0,0,0,0|3,0,1]=4 5 B18R2.92911 CC(=O)N(Cc1nccs1)c2ccc(cc2)O AIFCHEM-98288211608 [0,0,0,0,0,0|3,0,1]=4 6 B17R2.164 CCN(Cc1ccco1)c2ccc(cc2)C AIFCHEM-94537420081 [1,0,0,0,0,0|3,0,0]=4 7 B17R2.164 CCN(Cc1cccs1)c2ccc(cc2)C AIFCHEM-94537420082 [1,0,0,0,0,0|3,0,0]=4 8 B17R2.21294 CC(=O)N(Cc1ncco1)c2ccccc2 AIFCHEM-99350817477 [1,0,0,0,0,0|2,0,1]=4 9 B17R2.21294 CC(=O)N(Cc1nccs1)c2ccccc2 AIFCHEM-98288266825 [1,0,0,0,0,0|2,0,1]=4 10 B19R2.45754 CC(=O)N(Cc1ncc(s1)Cl)c2ccc(cc2)Cl AIFCHEM-99350830602 [0,1,0,0,0,0|2,0,1]=4 11 B19R2.150518 CC(=O)N(Cc1ncco1)c2ccc(c(c2)C)Cl AIFCHEM-40378612119 [0,1,0,0,0,0|2,0,1]=4 12 B19R2.150518 CC(=O)N(Cc1ncco1)c2ccc(c(c2)Cl)Cl AIFCHEM-99350802170 [0,1,0,0,0,0|2,0,1]=4 13 B19R2.150518 CC(=O)N(Cc1nccs1)c2ccc(c(c2)C)Cl AIFCHEM-40378792394 [0,1,0,0,0,0|2,0,1]=4 14 B19R2.150518 CC(=O)N(Cc1nccs1)c2ccc(c(c2)Cl)Cl AIFCHEM-99353262412 [0,1,0,0,0,0|2,0,1]=4 15 B19R2.506139 CC(=O)N(Cc1nccs1)c2ccc(cc2C)Cl AIFCHEM-40378627458 [0,1,0,0,0,0|2,0,1]=4 16 B19R3.59079 CC1Cc2cc(ccc2N1Cc3cc[nH]n3)F AIFCHEM-94524668896 [0,0,0,1,0,0|2,1,0]=4 17 B19R3.59079 Cc1ccc2c(c1)CC(N2Cc3ccco3)C AIFCHEM-94540092476 [0,0,0,1,0,0|3,0,0]=4 18 B19R3.59079 Cc1ccc2c(c1)CC(N2Cc3nccs3)C AIFCHEM-5978882719 [0,0,0,1,0,0|2,0,0]=3 19 B19R2.12369 CC(=O)N(Cc1ccccn1)c2ccc(cc2)Cl AIFCHEM-99350787652 [0,0,0,0,0,1|2,0,1]=4 20 B19R2.12369 CC(C)N(Cc1ccncn1)c2ccc(cc2)F AIFCHEM-5862709721 [0,0,0,0,0,1|1,1,0]=3 21 B19R2.149437 CC(C)C(NCc1c[nH]cn1)c2ccc(cc2)Cl AIFCHEM-94519111714 [0,0,0,0,0,1|3,0,0]=4 22 B19R2.149437 CC(C)C(NCc1cocn1)c2ccc(cc2)Cl AIFCHEM-94519109168 [0,0,0,0,0,1|3,0,0]=4 23 B19R2.149437 CC(C)C(NCc1cscn1)c2ccc(cc2)Cl AIFCHEM-94519111916 [0,0,0,0,0,1|3,0,0]=4 24 B19R2.149437 CC(C)C(NCc1ncc[nH]1)c2ccc(cc2)Cl AIFCHEM-94519108582 [0,0,0,0,0,1|1,0,0]=2 25 B19R2.149501 CC(=O)N(Cc1ccc(cc1)Cl)Cc2ncco2 AIFCHEM-40382675362 [0,0,0,0,0,1|2,0,1]=4 26 B19R2.149522 Cc1ccc(cc1)N(Cc2cccs2)CC(C)C AIFCHEM-94572979419 [0,0,0,0,0,1|3,0,0]=4 27 B16R2.125 CN(Cc1ncco1)c2ccc(cc2)Br AIFCHEM-6154640655 [2,0,0,0,0,0|1,1,0]=4 28 B16R2.125 CN(Cc1nccs1)c2ccc(cc2)Br AIFCHEM-6154397567 [2,0,0,0,0,0|1,1,0]=4 29 B16R2.125 Cc1ccc(cc1)N(C)Cc2ncco2 AIFCHEM-6061928730 [2,0,0,0,0,0|2,0,0]=4 30 B18R2.78653 CCN(Cc1ncco1)c2ccc(c(c2)C)C AIFCHEM-94568683869 [1,1,0,0,0,0|2,0,0]=4 31 B18R2.78653 CCN(Cc1nccs1)c2ccc(c(c2)C)C AIFCHEM-94568678829 [1,1,0,0,0,0|2,0,0]=4 32 B18R2.29833 CC(C)N(Cc1ncc(s1)Cl)c2ccccc2 AIFCHEM-5723430215 [1,1,0,0,0,0|1,0,0]=3 33 B18R2.29833 Cc1cnc(s1)CN(c2ccccc2)C(C)C AIFCHEM-5723457455 [1,1,0,0,0,0|1,0,0]=3 34 B20R2.16041 CC(C)N(Cc1ccccc1O)c2ccc(cc2)Cl AIFCHEM-94532469418 [0,1,0,0,0,1|2,0,0]=4 35 B20R2.16041 CC(C)N(Cc1cccnc1O)c2ccc(cc2)Cl AIFCHEM-94541107291 [0,1,0,0,0,1|1,0,0]=3 36 B20R2.240817 CC(C)C(NCc1ccc([nH]1)Br)c2ccc(cc2)Cl AIFCHEM-94519114989 [0,1,0,0,0,1|2,0,0]=4 37 B20R2.240817 CC(C)C(NCc1nc(cs1)Br)c2ccc(cc2)Cl AIFCHEM-94519110395 [0,1,0,0,0,1|2,0,0]=4 38 B20R2.240817 CC(C)C(NCc1ncc(s1)Br)c2ccc(cc2)Cl AIFCHEM-5997113732 [0,1,0,0,0,1|2,0,0]=4 39 B20R2.240817 Cc1ccc([nH]1)CNC(c2ccc(cc2)Cl)C(C)C AIFCHEM-94519109187 [0,1,0,0,0,1|2,0,0]=4 40 B20R2.240817 Cc1cnc(s1)CNC(c2ccc(cc2)Cl)C(C)C AIFCHEM-94519109857 [0,1,0,0,0,1|2,0,0]=4 41 B20R2.240817 Cc1nnc([nH]1)CNC(c2ccc(cc2)Cl)C(C)C AIFCHEM-94519113149 [0,1,0,0,0,1|2,0,0]=4 42 B20R2.68266 CC(C)N(Cc1cocn1)C(=O)c2ccc(cc2)Cl AIFCHEM-98362718309 [0,1,0,0,0,1|2,0,0]=4 43 B20R2.68266 CC(C)N(Cc1cscn1)C(=O)c2ccc(cc2)Cl AIFCHEM-98362774870 [0,1,0,0,0,1|2,0,0]=4 44 B20R2.68266 CC(C)N(Cc1ncc[nH]1)C(=O)c2ccc(cc2)Br AIFCHEM-5887414791 [0,1,0,0,0,1|0,1,0]=3 45 B20R2.68266 CC(C)N(Cc1ncc[nH]1)C(=O)c2ccc(cc2)Cl AIFCHEM-94519630847 [0,1,0,0,0,1|0,0,0]=2 46 B20R2.68266 CC(C)N(Cc1ncc[nH]1)C(=O)c2cnc(cn2)Cl AIFCHEM-5887162463 [0,1,0,0,0,1|2,0,0]=4 47 B20R2.68266 CC(C)N(Cc1ncco1)C(=O)c2ccc(cc2)Br AIFCHEM-98167726597 [0,1,0,0,0,1|1,1,0]=4 48 B20R2.68266 CC(C)N(Cc1ncco1)C(=O)c2ccc(cc2)Cl AIFCHEM-98362797351 [0,1,0,0,0,1|1,0,0]=3 49 B20R2.68266 CC(C)N(Cc1ncco1)C(=O)c2ccc(cc2)F AIFCHEM-97692294976 [0,1,0,0,0,1|1,1,0]=4 50 B20R2.68266 CC(C)N(Cc1ncco1)C(=O)c2ccc(cc2)I AIFCHEM-98056153568 [0,1,0,0,0,1|1,1,0]=4 51 B20R2.68266 CC(C)N(Cc1ncco1)C(=O)c2ccc(cn2)Cl AIFCHEM-98226372859 [0,1,0,0,0,1|2,0,0]=4 52 B20R2.68266 CC(C)N(Cc1nccs1)C(=O)c2ccc(cc2)Br AIFCHEM-98168071368 [0,1,0,0,0,1|1,1,0]=4 53 B20R2.68266 CC(C)N(Cc1nccs1)C(=O)c2ccc(cc2)Cl AIFCHEM-98363024842 [0,1,0,0,0,1|1,0,0]=3 54 B20R2.68266 CC(C)N(Cc1nccs1)C(=O)c2ccc(cc2)F AIFCHEM-97692557907 [0,1,0,0,0,1|1,1,0]=4 55 B20R2.68266 CC(C)N(Cc1nccs1)C(=O)c2ccc(cc2)I AIFCHEM-98056355059 [0,1,0,0,0,1|1,1,0]=4 56 B20R2.68266 CC(C)N(Cc1nccs1)C(=O)c2ccc(cn2)Cl AIFCHEM-98226619170 [0,1,0,0,0,1|2,0,0]=4 57 B20R2.68266 Cc1ccc(cc1)C(=O)N(Cc2ncc[nH]2)C(C)C AIFCHEM-5886878853 [0,1,0,0,0,1|1,0,0]=3 58 B20R2.68266 Cc1ccc(cc1)C(=O)N(Cc2ncco2)C(C)C AIFCHEM-98382771852 [0,1,0,0,0,1|2,0,0]=4 59 B20R2.68266 Cc1ccc(cc1)C(=O)N(Cc2nccs2)C(C)C AIFCHEM-98383297603 [0,1,0,0,0,1|2,0,0]=4 60 B20R2.235893 CC(C)C(=O)N(Cc1ncco1)c2ccc(cc2)Br AIFCHEM-99366769810 [0,1,0,0,0,1|1,1,0]=4 61 B20R2.235893 CC(C)C(=O)N(Cc1ncco1)c2ccc(cc2)O AIFCHEM-99366154875 [0,1,0,0,0,1|2,0,0]=4 62 B20R2.235893 CC(C)C(=O)N(Cc1nccs1)c2ccc(cc2)Br AIFCHEM-99366145926 [0,1,0,0,0,1|1,1,0]=4 63 B20R2.235893 CC(C)C(=O)N(Cc1nccs1)c2ccc(cc2)O AIFCHEM-99366268702 [0,1,0,0,0,1|2,0,0]=4 64 B20R2.235893 Cc1ccc(cc1)N(Cc2ncco2)C(=O)C(C)C AIFCHEM-99366365349 [0,1,0,0,0,1|2,0,0]=4 65 B20R2.235893 Cc1ccc(cc1)N(Cc2nccs2)C(=O)C(C)C AIFCHEM-99366344077 [0,1,0,0,0,1|2,0,0]=4 66 B20R2.279331 CCn1ccnc1CN(C(=O)C)c2ccc(cc2)Cl AIFCHEM-98288158927 [0,2,0,0,0,0|1,0,1]=4 67 B18R3.3190 Clc1ccc2c(c1)CCN2Cc3cccs3 AIFCHEM-94580621359 [1,0,0,1,0,0|2,0,0]=4 68 B18R3.3190 Oc1ccc2c(c1)CCN2Cc3ncco3 AIFCHEM-6023834048 [1,0,0,1,0,0|2,0,0]=4 69 B18R3.6371 CC1Cc2ccccc2N1Cc3ncco3 AIFCHEM-5887575721 [1,0,0,1,0,0|1,0,0]=3 70 B20R3.6008 Cc1ccc2c(c1)CC(N2Cc3cccnc3)C AIFCHEM-5888266256 [0,0,0,1,0,1|2,0,0]=4 71 B20R3.6008 Cc1ccc2c(c1)CC(N2Cc3cnccn3)C AIFCHEM-5912503428 [0,0,0,1,0,1|1,0,1]=4 72 B20R3.5821482 Clc1ccc(cc1)C(NCc2nccs2)C3CC3 AIFCHEM-94520351912 [0,0,0,1,0,1|2,0,0]=4 73 B20R3.99825 CC1(CN(c2c1cc(cc2)Br)Cc3nccs3)C AIFCHEM-6153417560 [0,0,0,1,0,1|1,1,0]=4 74 B20R3.5823321 Clc1ccc(cc1)N(Cc2ncc[nH]2)CC3CC3 AIFCHEM-6097204294 [0,0,0,1,0,1|0,0,0]=2 75 B20R3.100548 CC1CCc2cc(ccc2N1Cc3nccs3)F AIFCHEM-6062502778 [0,1,0,1,0,0|1,1,0]=4 76 B20R3.12335760 Cc1ccc2c(c1)CC(N2Cc3cc(c[nH]3)Br)C AIFCHEM-5888083971 [0,1,0,1,0,0|2,0,0]=4 77 B20R3.12335760 Cc1ccc2c(c1)CC(N2Cc3ncc(s3)Br)C AIFCHEM-5978928123 [0,1,0,1,0,0|2,0,0]=4 78 B18R2.3608 CCC(NCc1ncc[nH]1)c2ccc(cc2)C AIFCHEM-94560082840 [1,0,0,0,0,1|2,0,0]=4 79 B18R2.3608 CCC(NCc1nccs1)c2ccc(cc2)Cl AIFCHEM-94541004781 [1,0,0,0,0,1|2,0,0]=4 80 B18R2.3608 CC[C@@H](NCc1nccs1)c2ccc(cc2)Cl AIFCHEM-5810276574 [1,0,0,0,0,1|2,0,0]=4 81 B18R2.3608 CC[C@H](NCc1ncc[nH]1)c2ccc(cc2)C AIFCHEM-6061831856 [1,0,0,0,0,1|2,0,0]=4 82 B18R2.3608 CC[C@H](NCc1nccs1)c2ccc(cc2)Cl AIFCHEM-94552309237 [1,0,0,0,0,1|2,0,0]=4 83 B18R2.7819 CCN(Cc1ccc(cc1)Cl)Cc2c[nH]cn2 AIFCHEM-94549924725 [1,0,0,0,0,1|2,0,0]=4 84 B18R2.7819 CCN(Cc1ccc(cc1)Cl)Cc2cocn2 AIFCHEM-94549922179 [1,0,0,0,0,1|2,0,0]=4 85 B18R2.7819 CCN(Cc1ccc(cc1)F)Cc2ncco2 AIFCHEM-5874733560 [1,0,0,0,0,1|1,1,0]=4 86 B18R2.7819 CCN(Cc1ccc(cc1)F)Cc2nccs2 AIFCHEM-5831191446 [1,0,0,0,0,1|1,1,0]=4 87 B18R2.7819 CCN(Cc1ccc(cc1)O)Cc2ncco2 AIFCHEM-6141640766 [1,0,0,0,0,1|2,0,0]=4 88 B18R2.4111 CC(C)N(Cc1cccnc1)c2ccccc2 AIFCHEM-5704782832 [1,0,0,0,0,1|1,0,0]=3 89 B18R2.12689 CC(C)C(NCc1ncc[nH]1)c2ccccc2 AIFCHEM-94525123059 [1,0,0,0,0,1|1,0,0]=3 90 B18R2.12689 CC(C)C(NCc1ncco1)c2ccccc2 AIFCHEM-94525128150 [1,0,0,0,0,1|2,0,0]=4 91 B18R2.12689 CC(C)[C@@H](NCc1ncc[nH]1)c2ccccc2 AIFCHEM-94530695061 [1,0,0,0,0,1|1,0,0]=3 92 B18R2.12689 CC(C)[C@@H](NCc1ncco1)c2ccccc2 AIFCHEM-94530700152 [1,0,0,0,0,1|2,0,0]=4 93 B18R2.12689 CC(C)[C@H](NCc1ncc[nH]1)c2ccccc2 AIFCHEM-5592718563 [1,0,0,0,0,1|1,0,0]=3 94 B18R2.12689 CC(C)[C@H](NCc1ncco1)c2ccccc2 AIFCHEM-94528559310 [1,0,0,0,0,1|2,0,0]=4 95 B18R2.33880 CC(C)N(Cc1cccnc1)Cc2nccs2 AIFCHEM-5898906646 [1,0,0,0,0,1|2,0,0]=4 96 B20R2.16040 CC(C)CN(Cc1cccnc1)c2ccc(cc2)Cl AIFCHEM-94572979139 [0,0,0,0,0,2|1,0,0]=3 97 B20R2.68279 CC(C)N(Cc1ccc(cc1)Cl)Cc2cccnc2 AIFCHEM-5899158496 [0,0,0,0,0,2|1,0,0]=3 98 B20R2.68279 Cc1ccc(cc1)CN(Cc2cccnc2)C(C)C AIFCHEM-5975964946 [0,0,0,0,0,2|2,0,0]=4 99 B20R2.235901 CC(C)C(NCc1cccnc1)c2ccc(cc2)Cl AIFCHEM-6238116750 [0,0,0,0,0,2|2,0,0]=4 100 B20R2.235901 CC(C)C(NCc1ccncn1)c2ccc(cc2)Cl AIFCHEM-94598726487 [0,0,0,0,0,2|2,0,0]=4 101 B20R2.235901 CC(C)C(NCc1cnccn1)c2ccc(cc2)Cl AIFCHEM-5844253535 [0,0,0,0,0,2|1,0,1]=4