0 B9R1.11 C/C=C(\C)/c1c[nH]cn1 AIFCHEM-94584216113 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.11 C/C=C(\C)/c1ccco1 AIFCHEM-94584220027 [0,0,0,0,0,0|2,0,1]=3 2 B9R1.11 C/C=C(\C)/c1ccns1 AIFCHEM-94584219593 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.11 C/C=C(\C)/c1ccoc1 AIFCHEM-94584215864 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.11 C/C=C(\C)/c1cnco1 AIFCHEM-94584215133 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.11 C/C=C(\C)/c1cscn1 AIFCHEM-94584217508 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.11 C/C=C(\C)/c1ncco1 AIFCHEM-94584211505 [0,0,0,0,0,0|2,0,2]=4 7 B9R1.11 C/C=C(\C)/c1nccs1 AIFCHEM-94584217073 [0,0,0,0,0,0|2,0,2]=4 8 B8R1.8 CC=Cc1ncc[nH]1 AIFCHEM-6407688555 [1,0,0,0,0,0|1,0,1]=3 9 B8R1.8 CCNc1ccsc1 AIFCHEM-94568866699 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.8 CCNc1cscn1 AIFCHEM-94537423279 [1,0,0,0,0,0|2,0,1]=4 11 B10R1.11 CCN[C@H](C)c1ccco1 AIFCHEM-94537422471 [0,1,0,0,0,0|2,0,1]=4 12 B10R1.149 C/C=C(\C)/c1nccn1C AIFCHEM-94584214074 [0,1,0,0,0,0|2,0,1]=4 13 B10R1.15 C/C=C(\C)/c1ccccn1 AIFCHEM-94584209692 [0,0,0,0,0,1|1,0,2]=4 14 B10R1.15 C/C=C(\C)/c1cccnn1 AIFCHEM-94584222994 [0,0,0,0,0,1|1,0,2]=4 15 B10R1.15 C/C=C(\C)/c1cnccn1 AIFCHEM-94584219793 [0,0,0,0,0,1|1,0,2]=4 16 B10R1.15 CCN(C)c1cccnc1 AIFCHEM-94537417258 [0,0,0,0,0,1|2,0,1]=4 17 B10R1.27 CCC(=O)Nc1ccon1 AIFCHEM-94526503544 [0,0,0,0,0,1|1,0,1]=3 18 B10R1.27 CCC(=O)Nc1cnns1 AIFCHEM-94526507238 [0,0,0,0,0,1|3,0,0]=4 19 B10R1.27 CCC(=O)Nc1cscn1 AIFCHEM-94557128905 [0,0,0,0,0,1|1,0,1]=3 20 B10R1.27 CCC(=O)Nc1ncco1 AIFCHEM-94526507592 [0,0,0,0,0,1|1,0,1]=3 21 B10R1.27 CCN(C)Cc1ccco1 AIFCHEM-94537421946 [0,0,0,0,0,1|3,0,0]=4 22 B10R1.27 O=C(CO)Nc1ccn[nH]1 AIFCHEM-94519999816 [0,0,0,0,0,1|2,0,0]=3 23 B10R1.27 O=C(CO)Nc1nccs1 AIFCHEM-94524297920 [0,0,0,0,0,1|2,0,1]=4 24 B9R1.7 CC=Cc1cc(cs1)C AIFCHEM-6392720398 [1,1,0,0,0,0|1,0,1]=4 25 B9R1.7 CCNc1cc(n[nH]1)Br AIFCHEM-94548018960 [1,1,0,0,0,0|2,0,0]=4 26 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [1,1,0,0,0,0|1,0,1]=4 27 B9R1.12 OCC=Cc1ncc[nH]1 AIFCHEM-6393592582 [1,1,0,0,0,0|1,0,1]=4 28 B9R1.13 CC(=Cc1cccs1)C AIFCHEM-94564040356 [1,1,0,0,0,0|1,0,1]=4 29 B9R1.13 CC(=Cc1ncc[nH]1)C AIFCHEM-6485154680 [1,1,0,0,0,0|1,0,1]=4 30 B9R1.33 CC=Cc1[nH]ncc1C AIFCHEM-6342958907 [1,1,0,0,0,0|1,0,1]=4 31 B9R1.33 CC=Cc1ccnn1C AIFCHEM-6483064088 [1,1,0,0,0,0|1,0,1]=4 32 B9R1.33 CC=Cc1cncn1C AIFCHEM-6429493094 [1,1,0,0,0,0|1,0,1]=4 33 B11R1.30 C#CCC(=O)Nc1ccn[nH]1 AIFCHEM-94519995828 [0,1,0,0,0,1|1,0,1]=4 34 B11R1.30 COCC(=O)Nc1ccsc1 AIFCHEM-94568875101 [0,1,0,0,0,1|2,0,0]=4 35 B11R1.30 CSCC(=O)Nc1ncco1 AIFCHEM-6262822610 [0,1,0,0,0,1|1,0,1]=4 36 B11R1.30 N#CCC(=O)Nc1ccn[nH]1 AIFCHEM-94559911403 [0,1,0,0,0,1|1,0,1]=4 37 B11R1.30 O=C(CCO)Nc1ccsc1 AIFCHEM-94568874150 [0,1,0,0,0,1|2,0,0]=4 38 B11R1.30 O=C(CCO)Nc1cscn1 AIFCHEM-94557127025 [0,1,0,0,0,1|1,0,1]=4 39 B11R1.35 CC(O)C(=O)Nc1ccon1 AIFCHEM-94571302760 [0,1,0,0,0,1|1,0,1]=4 40 B11R1.39 CCC(=O)Nc1cc(ns1)C AIFCHEM-94526508082 [0,1,0,0,0,1|2,0,0]=4 41 B11R1.39 CCC(=O)Nc1nc(cs1)C AIFCHEM-94526508975 [0,1,0,0,0,1|1,0,1]=4 42 B11R1.39 CCC(=O)Nc1nc(cs1)Cl AIFCHEM-94526508037 [0,1,0,0,0,1|1,0,1]=4 43 B11R1.39 CCC(=O)Nc1ncc(s1)F AIFCHEM-94556986659 [0,1,0,0,0,1|1,0,1]=4 44 B11R1.39 CCN(C)Cc1ccc([nH]1)C AIFCHEM-94563255400 [0,1,0,0,0,1|2,0,0]=4 45 B11R1.39 O=C(CO)Nc1cc(n[nH]1)Br AIFCHEM-94548029706 [0,1,0,0,0,1|2,0,0]=4 46 B11R1.29 C#CCNC(=O)c1ccc[nH]1 AIFCHEM-94588320324 [0,2,0,0,0,0|0,0,1]=3 47 B11R1.29 CCCNC(=O)c1cc[nH]n1 AIFCHEM-94576494631 [0,2,0,0,0,0|1,0,1]=4 48 B11R1.29 CCCNC(=O)c1ccco1 AIFCHEM-94521381097 [0,2,0,0,0,0|1,0,0]=3 49 B11R1.29 CCCNC(=O)c1ccno1 AIFCHEM-5791444319 [0,2,0,0,0,0|2,0,0]=4 50 B11R1.29 CCCNC(=O)c1cncs1 AIFCHEM-5791023939 [0,2,0,0,0,0|2,0,0]=4 51 B11R1.29 CCCNC(=O)c1nccs1 AIFCHEM-94521374375 [0,2,0,0,0,0|1,0,1]=4 52 B11R1.29 O=C(NCCF)c1cc[nH]c1 AIFCHEM-5801854197 [0,2,0,0,0,0|2,0,0]=4 53 B11R1.29 O=C(NCCF)c1ccc[nH]1 AIFCHEM-5802205843 [0,2,0,0,0,0|0,0,0]=2 54 B11R1.77 CC(C)NC(=O)c1ccc[nH]1 AIFCHEM-94520550346 [0,2,0,0,0,0|0,0,0]=2 55 B11R1.77 CC(C)NC(=O)c1ncc[nH]1 AIFCHEM-94520545556 [0,2,0,0,0,0|1,0,0]=3 56 B11R2.2 C1=C(CCO1)c2ccco2 AIFCHEM-94557632059 [0,1,0,1,0,0|1,0,1]=4 57 B11R2.2 C1=C(CNC1)c2cccs2 AIFCHEM-94564041123 [0,1,0,1,0,0|2,0,0]=4 58 B9R1.8 CCNc1ccccn1 AIFCHEM-94537422158 [1,0,0,0,0,1|1,0,1]=4 59 B9R1.8 CCNc1cnccn1 AIFCHEM-94537422176 [1,0,0,0,0,1|1,0,1]=4 60 B11R1.40 CCC(=O)Nc1ccccn1 AIFCHEM-94526506315 [0,0,0,0,0,2|0,0,1]=3 61 B11R1.40 CCC(=O)Nc1cccnn1 AIFCHEM-94554024128 [0,0,0,0,0,2|0,0,1]=3 62 B11R1.40 O=C(CO)Nc1cccnc1 AIFCHEM-94531016168 [0,0,0,0,0,2|1,0,1]=4 63 B11R1.25 CCC(=O)NCc1cnco1 AIFCHEM-94526501982 [0,0,0,0,0,2|2,0,0]=4 64 B11R1.25 CCC(=O)NCc1cncs1 AIFCHEM-94526501531 [0,0,0,0,0,2|2,0,0]=4 65 B11R1.25 CCC(=O)NCc1cnn[nH]1 AIFCHEM-94526498954 [0,0,0,0,0,2|2,0,0]=4