0 B11R1.77 CC(C)NC(=O)c1ccc[nH]1 AIFCHEM-94520550346 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.66 CC(=O)NCc1ccc[nH]1 AIFCHEM-94605343937 [1,0,0,0,0,0|2,0,1]=4 2 B10R1.66 CC(=O)NCc1cccs1 AIFCHEM-6123944273 [1,0,0,0,0,0|1,1,1]=4 3 B12R1.15 CCC(=O)N[C@H](C)c1ccco1 AIFCHEM-94526508113 [0,1,0,0,0,0|2,0,1]=4 4 B12R1.15 COC(=O)CC(=O)N1CC=CC1 AIFCHEM-94544850127 [0,1,0,0,0,0|2,0,1]=4 5 B12R1.103 CC(C)NC(=O)c1cc(co1)Br AIFCHEM-94520548272 [0,1,0,0,0,0|2,0,1]=4 6 B12R1.103 CC(C)NC(=O)c1ccc(o1)Cl AIFCHEM-94520550218 [0,1,0,0,0,0|2,0,1]=4 7 B12R1.476 CCC(NC(=O)C)c1ccco1 AIFCHEM-94605350504 [0,1,0,0,0,0|2,0,1]=4 8 B12R2.6 Cc1nnc(o1)c2ccco2 AIFCHEM-94583462658 [0,0,0,1,0,0|3,0,0]=4 9 B12R2.6 O=C1C=C(CC1)c2cnco2 AIFCHEM-6331071127 [0,0,0,1,0,0|2,0,1]=4 10 B12R2.6 O=C1C=C(CC1)c2ncco2 AIFCHEM-6309213823 [0,0,0,1,0,0|2,0,1]=4 11 B12R1.54 CC(=O)CCC(=O)N1CC=CC1 AIFCHEM-6125344041 [0,0,0,0,0,1|2,0,1]=4 12 B12R1.54 CC(=O)CNC(=O)c1cnco1 AIFCHEM-6058146044 [0,0,0,0,0,1|1,0,0]=2 13 B12R1.54 CC(=O)CNC(=O)c1cscn1 AIFCHEM-6018648860 [0,0,0,0,0,1|2,0,0]=3 14 B12R1.54 CC(=O)SCC(=O)N1CC=CC1 AIFCHEM-94528299271 [0,0,0,0,0,1|2,0,1]=4 15 B12R1.54 CC(C)CNC(=O)c1ccco1 AIFCHEM-6162410015 [0,0,0,0,0,1|1,0,1]=3 16 B12R1.54 NC(=O)CNC(=O)c1cc[nH]c1 AIFCHEM-5604002627 [0,0,0,0,0,1|3,0,0]=4 17 B12R1.54 NC(=O)CNC(=O)c1cncs1 AIFCHEM-94550122991 [0,0,0,0,0,1|2,1,0]=4 18 B12R1.54 NC(=O)CNC(=O)c1nccs1 AIFCHEM-5652985661 [0,0,0,0,0,1|2,1,0]=4 19 B12R1.260 NC(=O)CC(=O)Nc1ccsc1 AIFCHEM-94568872044 [0,0,0,0,0,1|3,0,0]=4 20 B9R1.11 C/C=C(\C)/c1ccco1 AIFCHEM-94584220027 [2,0,0,0,0,0|1,0,0]=3 21 B9R1.11 C/C=C(\C)/c1cnco1 AIFCHEM-94584215133 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.11 C/C=C(\C)/c1ncco1 AIFCHEM-94584211505 [2,0,0,0,0,0|2,0,0]=4 23 B11R1.29 CCCNC(=O)c1ccco1 AIFCHEM-94521381097 [1,1,0,0,0,0|0,0,1]=3 24 B11R1.29 CCCNC(=O)c1ccno1 AIFCHEM-5791444319 [1,1,0,0,0,0|1,0,1]=4 25 B11R1.75 CC(=O)NCc1ccc(o1)Br AIFCHEM-94535592842 [1,1,0,0,0,0|1,0,1]=4 26 B13R1.129 CC(=O)CNC(=O)c1ccc(o1)Br AIFCHEM-6074916580 [0,1,0,0,0,1|0,0,0]=2 27 B13R1.129 CC(=O)CNC(=O)c1ccc(s1)C AIFCHEM-6038587307 [0,1,0,0,0,1|0,1,0]=3 28 B13R1.129 CC(=O)CNC(=O)c1cnc(o1)C AIFCHEM-6074825379 [0,1,0,0,0,1|1,0,0]=3 29 B13R1.129 CC(=O)CNC(=O)c1cnc(s1)C AIFCHEM-6057912519 [0,1,0,0,0,1|1,1,0]=4 30 B13R1.129 CC(=O)CNC(=O)c1coc(c1)Br AIFCHEM-6074893735 [0,1,0,0,0,1|2,0,0]=4 31 B13R1.129 Cc1ccc([nH]1)C(=O)NCC(=O)N AIFCHEM-5634817891 [0,1,0,0,0,1|2,0,0]=4 32 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)Br AIFCHEM-5604019085 [0,1,0,0,0,1|1,1,0]=4 33 B13R1.129 NC(=O)CNC(=O)c1ccc(s1)F AIFCHEM-5653018592 [0,1,0,0,0,1|1,1,0]=4 34 B13R1.162 CCC(=O)CNC(=O)c1cc[nH]n1 AIFCHEM-94576494721 [0,1,0,0,0,1|2,0,0]=4 35 B13R1.162 CCC(=O)CNC(=O)c1ccns1 AIFCHEM-6166943636 [0,1,0,0,0,1|1,1,0]=4 36 B13R1.162 CCC(=O)CNC(=O)c1ccon1 AIFCHEM-6148989938 [0,1,0,0,0,1|2,0,0]=4 37 B13R1.162 CCC(=O)CNC(=O)c1nccs1 AIFCHEM-6158785574 [0,1,0,0,0,1|1,1,0]=4 38 B13R1.162 CNC(=O)CNC(=O)c1ccc[nH]1 AIFCHEM-94562553774 [0,1,0,0,0,1|1,0,0]=3 39 B13R1.162 CNC(=O)CNC(=O)c1ccoc1 AIFCHEM-94562552625 [0,1,0,0,0,1|2,0,0]=4 40 B13R1.162 CNC(=O)CNC(=O)c1ccon1 AIFCHEM-5912723894 [0,1,0,0,0,1|2,0,0]=4 41 B13R1.162 CNC(=O)CNC(=O)c1ccsc1 AIFCHEM-94562555139 [0,1,0,0,0,1|2,0,0]=4 42 B13R1.162 COC(=O)CNC(=O)c1c[nH]cn1 AIFCHEM-6194075862 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.168 CC(=O)CNC(=O)c1[nH]ccc1Br AIFCHEM-6012860915 [0,1,0,0,0,1|1,0,0]=3 44 B13R1.168 CC(=O)CNC(=O)c1[nH]ccc1F AIFCHEM-6038678598 [0,1,0,0,0,1|1,0,0]=3 45 B13R1.168 CC(=O)CNC(=O)c1cc[nH]c1C AIFCHEM-6019066158 [0,1,0,0,0,1|2,0,0]=4 46 B13R1.168 CC(=O)CNC(=O)c1ccsc1Br AIFCHEM-6038825796 [0,1,0,0,0,1|2,0,0]=4 47 B13R1.168 CC(=O)CNC(=O)c1ccsc1Cl AIFCHEM-6039614254 [0,1,0,0,0,1|2,0,0]=4 48 B13R1.168 CC(=O)CNC(=O)c1ncsc1C AIFCHEM-6074917328 [0,1,0,0,0,1|2,0,0]=4 49 B13R1.168 CC(=O)CNC(=O)c1sccc1C AIFCHEM-6018427590 [0,1,0,0,0,1|0,1,0]=3 50 B13R1.168 CC(=O)CNC(=O)c1sccc1Cl AIFCHEM-6058147578 [0,1,0,0,0,1|0,1,0]=3 51 B13R1.168 Cc1ccoc1C(=O)NCC(=O)N AIFCHEM-94550126796 [0,1,0,0,0,1|1,0,0]=3 52 B13R1.168 Cc1ccoc1C(=O)NCC(C)C AIFCHEM-94563731346 [0,1,0,0,0,1|1,0,1]=4 53 B13R1.168 Cc1cnoc1C(=O)NCC(=O)N AIFCHEM-5612108321 [0,1,0,0,0,1|2,0,0]=4 54 B13R1.168 Cc1ncoc1C(=O)NCC(=O)N AIFCHEM-5602646178 [0,1,0,0,0,1|2,0,0]=4 55 B13R1.168 Cn1cccc1C(=O)NCC(=O)N AIFCHEM-5611288321 [0,1,0,0,0,1|2,0,0]=4 56 B13R1.168 NC(=O)CNC(=O)c1[nH]ccc1Br AIFCHEM-5652664298 [0,1,0,0,0,1|2,0,0]=4 57 B13R1.168 NC(=O)CNC(=O)c1[nH]ccc1F AIFCHEM-94550124199 [0,1,0,0,0,1|2,0,0]=4 58 B13R1.168 NC(=O)CNC(=O)c1occc1Br AIFCHEM-5604558505 [0,1,0,0,0,1|1,0,0]=3 59 B13R1.339 CC(=O)C(C)NC(=O)c1cccs1 AIFCHEM-6090935169 [0,1,0,0,0,1|0,1,0]=3 60 B13R1.339 CC(=O)C(C)NC(=O)c1ccns1 AIFCHEM-6177978462 [0,1,0,0,0,1|1,1,0]=4 61 B13R1.339 CC(=O)C(C)NC(=O)c1ccoc1 AIFCHEM-6142426847 [0,1,0,0,0,1|2,0,0]=4 62 B13R1.339 CC(=O)C(C)NC(=O)c1ncc[nH]1 AIFCHEM-6091070152 [0,1,0,0,0,1|2,0,0]=4 63 B13R1.2780 CC(C)(C)CNC(=O)c1ccco1 AIFCHEM-5958698685 [0,1,0,0,0,1|1,0,1]=4 64 B13R1.2780 CC(C)(F)CNC(=O)c1ccco1 AIFCHEM-5712391216 [0,1,0,0,0,1|1,0,1]=4 65 B13R1.545 CNC(=O)CN(C)Cc1ccco1 AIFCHEM-94608447501 [0,1,0,0,0,1|2,0,0]=4 66 B13R1.545 COC(=O)CC(=O)Nc1ccn[nH]1 AIFCHEM-94549705645 [0,1,0,0,0,1|2,0,0]=4 67 B13R1.545 COC(=O)CC(=O)Nc1ccsc1 AIFCHEM-94568870543 [0,1,0,0,0,1|2,0,0]=4 68 B13R1.545 COC(=O)CN(C)Cc1ccco1 AIFCHEM-94540080251 [0,1,0,0,0,1|2,0,0]=4 69 B13R1.3424 Cc1ccc(s1)NC(=O)CC(=O)N AIFCHEM-6266891652 [0,1,0,0,0,1|1,1,0]=4 70 B11R1.86 CC(=O)Nc1ccccc1O AIFCHEM-94605355387 [0,0,1,1,0,0|2,0,0]=4 71 B9R1.13 CC(=Cc1cccs1)C AIFCHEM-94564040356 [1,0,0,0,1,0|1,1,0]=4 72 B9R1.13 CC(=O)Nc1ncco1 AIFCHEM-6274686839 [1,0,0,0,1,0|2,0,0]=4 73 B11R1.30 CSCC(=O)Nc1ncco1 AIFCHEM-6262822610 [1,0,0,0,0,1|2,0,0]=4 74 B13R1.45 CC(=O)CNC(=O)c1ccnnc1 AIFCHEM-6057952695 [0,0,0,0,0,2|2,0,0]=4 75 B13R1.45 CC(=O)CNC(=O)c1ncccn1 AIFCHEM-6018700719 [0,0,0,0,0,2|1,0,0]=3 76 B13R1.45 NC(=O)CNC(=O)c1ccccc1 AIFCHEM-94550128274 [0,0,0,0,0,2|2,0,0]=4 77 B13R1.45 NC(=O)CNC(=O)c1cccnc1 AIFCHEM-5611646960 [0,0,0,0,0,2|2,0,0]=4 78 B13R1.45 NC(=O)CNC(=O)c1cccnn1 AIFCHEM-5668958185 [0,0,0,0,0,2|2,0,0]=4 79 B13R1.45 NC(=O)CNC(=O)c1ccncc1 AIFCHEM-5653375543 [0,0,0,0,0,2|2,0,0]=4 80 B13R1.342 CC(=CCNC(=O)c1ccco1)C AIFCHEM-5932917059 [0,0,0,0,0,2|1,0,0]=3 81 B13R1.342 CC(=CCNC(=O)c1cnco1)C AIFCHEM-5962167915 [0,0,0,0,0,2|2,0,0]=4 82 B13R1.342 CC(=O)CCNC(=O)c1c[nH]cn1 AIFCHEM-6234883927 [0,0,0,0,0,2|2,0,0]=4 83 B13R1.342 CC(=O)CCNC(=O)c1cccs1 AIFCHEM-6193529832 [0,0,0,0,0,2|0,1,0]=3 84 B13R1.342 CC(=O)CCNC(=O)c1ccno1 AIFCHEM-6215054841 [0,0,0,0,0,2|1,0,0]=3 85 B13R1.342 CC(=O)CCNC(=O)c1ccoc1 AIFCHEM-6193719087 [0,0,0,0,0,2|2,0,0]=4 86 B13R1.342 CC(=O)CCNC(=O)c1cnco1 AIFCHEM-6218669779 [0,0,0,0,0,2|1,0,0]=3 87 B13R1.344 CC(=O)CCC(=O)Nc1cncs1 AIFCHEM-94535767121 [0,0,0,0,0,2|1,1,0]=4 88 B13R1.344 CC(=O)CNC(=O)Cc1ccn[nH]1 AIFCHEM-6038535862 [0,0,0,0,0,2|2,0,0]=4 89 B13R1.344 CC(=O)CNC(=O)Cc1nccs1 AIFCHEM-6038457146 [0,0,0,0,0,2|1,1,0]=4 90 B13R1.344 CC(=O)CNC(=O)Cn1cccc1 AIFCHEM-6038328851 [0,0,0,0,0,2|2,0,0]=4 91 B13R1.344 CC(=O)NCC(=O)Nc1cncs1 AIFCHEM-5654606635 [0,0,0,0,0,2|1,1,0]=4 92 B13R1.344 CC(=O)SCC(=O)Nc1ccno1 AIFCHEM-94528292642 [0,0,0,0,0,2|1,0,0]=3 93 B13R1.344 CC(=O)SCC(=O)Nc1ncco1 AIFCHEM-94528297641 [0,0,0,0,0,2|1,0,0]=3 94 B13R1.344 CC(=O)SCC(=O)Nc1nnco1 AIFCHEM-94528296924 [0,0,0,0,0,2|2,0,0]=4 95 B13R1.344 NC(=O)CNC(=O)Cc1ccc[nH]1 AIFCHEM-94550129052 [0,0,0,0,0,2|2,0,0]=4 96 B13R1.348 NC(=O)CC(=O)Nc1cccnc1 AIFCHEM-94531012181 [0,0,0,0,0,2|2,0,0]=4