0 B11R1.90 CC(C)NCc1occc1Br AIFCHEM-94520537820 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.66 CC(=O)NCc1ccc[nH]1 AIFCHEM-94605343937 [1,0,0,0,0,0|3,0,0]=4 2 B10R1.66 CC(=O)NCc1cccs1 AIFCHEM-6123944273 [1,0,0,0,0,0|2,1,0]=4 3 B12R1.129 CC(C)(C)NCc1occc1Br AIFCHEM-94589403991 [0,1,0,0,0,0|2,0,1]=4 4 B12R1.145 CC(C)N(C)Cc1occc1Br AIFCHEM-94547936769 [0,1,0,0,0,0|2,0,1]=4 5 B12R1.145 Cc1ccsc1CN(C)C(C)C AIFCHEM-94547939946 [0,1,0,0,0,0|1,1,1]=4 6 B12R1.353 CC(CO)NCc1occc1Br AIFCHEM-6411134038 [0,1,0,0,0,0|2,0,1]=4 7 B12R1.353 C[C@@H](CO)NCc1occc1Br AIFCHEM-6446533717 [0,1,0,0,0,0|2,0,1]=4 8 B12R1.353 C[C@H](CO)NCc1occc1Br AIFCHEM-6452440861 [0,1,0,0,0,0|2,0,1]=4 9 B12R2.466 Brc1ccoc1CNC2CC2 AIFCHEM-6108914728 [0,0,0,1,0,0|2,0,1]=4 10 B10R1.64 CC(=Cc1ccsc1C)C AIFCHEM-6298577487 [0,0,0,0,1,0|2,0,0]=3 11 B10R1.64 CC(=Cc1cnoc1C)C AIFCHEM-6370478528 [0,0,0,0,1,0|3,0,0]=4 12 B10R1.64 CC(=Cc1nncn1C)C AIFCHEM-6389862575 [0,0,0,0,1,0|3,0,0]=4 13 B10R1.64 CC(=Cc1sccc1C)C AIFCHEM-6323591551 [0,0,0,0,1,0|0,1,0]=2 14 B10R1.64 CC(=Cc1scnc1C)C AIFCHEM-6433248077 [0,0,0,0,1,0|1,1,0]=3 15 B12R1.125 Cc1cccnc1CNC(C)C AIFCHEM-94520540832 [0,0,0,0,0,1|2,0,1]=4 16 B12R1.130 CC(C)CNCc1occc1Br AIFCHEM-94563720197 [0,0,0,0,0,1|1,0,2]=4 17 B12R1.226 CC(=O)NCc1cccc(n1)C AIFCHEM-5718068665 [0,0,0,0,0,1|3,0,0]=4 18 B12R1.226 Cc1ccnc(c1)CNC(C)C AIFCHEM-94520540677 [0,0,0,0,0,1|2,0,1]=4 19 B9R1.12 CCNCc1ccco1 AIFCHEM-94594829503 [2,0,0,0,0,0|1,0,1]=4 20 B9R1.33 CC=Cc1[nH]ncc1C AIFCHEM-6342958907 [2,0,0,0,0,0|2,0,0]=4 21 B11R1.75 CC(=O)NCc1ccc(o1)Br AIFCHEM-94535592842 [1,1,0,0,0,0|2,0,0]=4 22 B11R1.510 CC(C)(C)C=Cc1ccco1 AIFCHEM-94557635146 [1,1,0,0,0,0|0,0,2]=4 23 B11R1.57 CC(=Cc1ccsc1CN)C AIFCHEM-5659411592 [0,1,0,0,1,0|2,0,0]=4 24 B11R1.57 CC(=Cc1sccc1CN)C AIFCHEM-5945212777 [0,1,0,0,1,0|0,1,0]=3 25 B11R1.57 CC(=Cc1sccc1CO)C AIFCHEM-6413085715 [0,1,0,0,1,0|0,1,0]=3 26 B11R1.57 CCc1ccsc1C=C(C)C AIFCHEM-6293575054 [0,1,0,0,1,0|0,1,0]=3 27 B11R1.57 CCn1ccnc1C=C(C)C AIFCHEM-6326128002 [0,1,0,0,1,0|2,0,0]=4 28 B11R1.313 CC(=Cc1ncn(c1C)C)C AIFCHEM-6420123006 [0,1,0,0,1,0|2,0,0]=4 29 B13R1.103 COc1ccoc1CNCC(C)C AIFCHEM-6122873860 [0,1,0,0,0,1|0,0,2]=4 30 B13R1.613 COc1ccoc1CNC(C)CO AIFCHEM-6432029532 [0,2,0,0,0,0|1,0,1]=4 31 B13R1.613 COc1ccoc1CN[C@@H](C)CO AIFCHEM-6438264353 [0,2,0,0,0,0|1,0,1]=4 32 B13R1.613 COc1ccoc1CN[C@H](C)CO AIFCHEM-6477215623 [0,2,0,0,0,0|1,0,1]=4 33 B11R2.385 C(=CC1CC1)c2ccco2 AIFCHEM-94569116302 [1,0,0,1,0,0|0,0,2]=4 34 B13R2.1650 COc1ccoc1CNC2CC2 AIFCHEM-94573315600 [0,1,0,1,0,0|1,0,1]=4 35 B9R1.13 CC(=Cc1cccs1)C AIFCHEM-94564040356 [1,0,0,0,1,0|0,1,0]=3 36 B9R1.13 CC(=Cc1ncc[nH]1)C AIFCHEM-6485154680 [1,0,0,0,1,0|2,0,0]=4 37 B12R1.108 CCN(C)C(=O)Cc1ccco1 AIFCHEM-94563266169 [1,2,0,0,0,0|1,0,0]=4 38 B14R1.4488 CC(=CCNC(=O)c1occc1C)C AIFCHEM-94550258046 [0,1,0,0,0,2|0,0,0]=3 39 B14R1.4488 CC(=CCNC(=O)c1sccc1C)C AIFCHEM-94550256332 [0,1,0,0,0,2|0,1,0]=4 40 B12R1.101 CC(=Cc1cc(cc(c1)O)C)C AIFCHEM-6368712770 [0,1,1,1,0,0|0,0,1]=4