0 B16R2.41276 COc1cccc(c1C=C2CCCC2)C AIFCHEM-6433722447 [0,0,0,0,0,0|3,0,0]=3 1 B16R2.41276 COc1cccc(c1C=C2CCCC2)F AIFCHEM-6345950394 [0,0,0,0,0,0|4,0,0]=4 2 B16R2.41276 COc1nccc(c1C=C2CCCC2)C AIFCHEM-6441714335 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.123 COc1ccccc1C=C2CCCC2 AIFCHEM-6365803358 [1,0,0,0,0,0|3,0,0]=4 4 B15R2.15371 Cc1cccc(c1C=C2CCCC2)O AIFCHEM-6359080077 [1,0,0,0,0,0|3,0,0]=4 5 B15R2.15371 Cc1cccc(c1NC2CCCC2)C AIFCHEM-94541531974 [1,0,0,0,0,0|2,0,1]=4 6 B15R1.2560 CC#CC(=O)Nc1c(cccc1OC)C AIFCHEM-5793203997 [0,0,1,0,0,0|1,0,2]=4 7 B15R1.2560 COc1cccc(c1NC(=O)CSC)C AIFCHEM-5845054004 [0,0,1,0,0,0|2,0,1]=4 8 B15R2.2453 COc1cccc(c1C=C2CCC2)F AIFCHEM-6320621584 [0,0,0,0,1,0|3,0,0]=4 9 B15R2.2453 COc1cccc(c1CN2CCC2)C AIFCHEM-94604923039 [0,0,0,0,1,0|3,0,0]=4 10 B15R2.2453 COc1nccc(c1NC2CCC2)C AIFCHEM-94576057428 [0,0,0,0,1,0|2,0,1]=4 11 B15R2.2493 CCc1cccc(c1C2=CCCC2)C AIFCHEM-6432486725 [0,0,0,0,1,0|3,0,0]=4 12 B15R2.2493 COc1cccc(c1C2=CCCC2)N AIFCHEM-5657866432 [0,0,0,0,1,0|3,0,0]=4 13 B15R2.2493 COc1cccc(c1C2=CCOC2)C AIFCHEM-6459748317 [0,0,0,0,1,0|3,0,0]=4 14 B15R2.2493 COc1cccc(c1C2=COCC2)C AIFCHEM-6427961361 [0,0,0,0,1,0|3,0,0]=4 15 B15R2.2493 COc1cccc(c1c2ncco2)C AIFCHEM-6315713092 [0,0,0,0,1,0|0,0,2]=3 16 B15R2.2493 COc1cccc(c1c2nccs2)C AIFCHEM-6317409357 [0,0,0,0,1,0|0,1,2]=4 17 B15R2.2493 COc1cccc(c1c2nncs2)C AIFCHEM-6344402609 [0,0,0,0,1,0|1,1,1]=4 18 B17R2.1791 CCc1cccc(c1NC2CCCOC2)C AIFCHEM-5718256014 [0,0,0,0,0,1|2,0,1]=4 19 B17R2.1791 COc1cccc(c1C=C2CCOCC2)C AIFCHEM-6459929542 [0,0,0,0,0,1|3,0,0]=4 20 B17R2.71328 COc1cccc(c1CNC2CCCC2)C AIFCHEM-94542377303 [0,0,0,0,0,1|2,0,1]=4 21 B17R2.71328 COc1cccc(c1CNc2ncco2)O AIFCHEM-6282646508 [0,0,0,0,0,1|1,0,2]=4 22 B17R2.71328 COc1cccc(c1NCc2ncco2)C AIFCHEM-5843590794 [0,0,0,0,0,1|0,0,2]=3 23 B14R1.2178 CCC(=O)Nc1c(cccc1OC)Br AIFCHEM-94526508323 [1,0,1,0,0,0|1,0,1]=4 24 B14R1.2178 CCC(=O)Nc1c(cccc1OC)F AIFCHEM-94526507518 [1,0,1,0,0,0|1,0,1]=4 25 B14R1.2178 COc1cccc(c1NC(=O)CO)C AIFCHEM-94532683115 [1,0,1,0,0,0|1,0,1]=4 26 B14R1.3381 CCOC=Cc1c(cccc1OC)O AIFCHEM-6376471179 [1,0,1,0,0,0|2,0,0]=4 27 B16R1.19758 COc1cccc(c1NC(=O)CC(C)C)C AIFCHEM-5793652807 [0,1,1,0,0,0|1,0,1]=4 28 B16R1.91108 CCC#CC(=O)Nc1c(cccc1OC)C AIFCHEM-5844743288 [0,1,1,0,0,0|1,0,1]=4 29 B16R1.91108 CCOCC(=O)Nc1c(cccc1SC)C AIFCHEM-5678721725 [0,1,1,0,0,0|1,1,0]=4 30 B16R2.20771 CCOc1cccc(c1NC2CCC2)C AIFCHEM-94576054891 [0,1,0,0,1,0|1,0,1]=4 31 B16R2.201364 COc1cccc(c1NC2CCC2)OC AIFCHEM-94576053175 [0,1,0,0,1,0|1,0,1]=4 32 B16R2.1512 COc1cccc(c1C2=CCCCO2)C AIFCHEM-6427590782 [0,0,1,1,0,0|2,0,0]=4 33 B14R2.5333 Cc1cccc(c1NC2CCC2)C AIFCHEM-94576050625 [1,0,0,0,1,0|1,0,1]=4 34 B16R2.172 COc1ccccc1NC2CCCOC2 AIFCHEM-94546765905 [1,0,0,0,0,1|1,0,1]=4 35 B16R2.25778 Cc1cccc(c1CNc2ncco2)O AIFCHEM-6274632209 [1,0,0,0,0,1|0,0,2]=4 36 B18R2.118118 COc1cccc(c1CNCC2OCCO2)C AIFCHEM-5608825225 [0,0,0,0,0,2|1,0,1]=4