0 B16R2.1054 CCNCc1nc2ccccc2c(=O)[nH]1 AIFCHEM-94537421664 [0,0,0,0,0,0|3,0,1]=4 1 B15R2.886 CC=Cc1cc(c2ncccc2c1)F AIFCHEM-6339674533 [1,0,0,0,0,0|3,0,0]=4 2 B15R2.886 CCNc1cc(c2ccccc2c1)Br AIFCHEM-94537425083 [1,0,0,0,0,0|3,0,0]=4 3 B17R2.12072 CCCC=Cc1cc(c2ncccc2c1)C AIFCHEM-6323746432 [0,1,0,0,0,0|3,0,0]=4 4 B17R2.12072 CCCC=Cc1cc2ccccc2c(n1)N AIFCHEM-5603855454 [0,1,0,0,0,0|2,0,0]=3 5 B17R2.12072 CCOC=Cc1cc2ccccc2c(=O)[nH]1 AIFCHEM-94580719434 [0,1,0,0,0,0|1,0,0]=2 6 B17R2.40403 CC(O)C=Cc1cc(c2ncccc2c1)F AIFCHEM-6331801879 [0,1,0,0,0,0|3,0,0]=4 7 B17R2.40403 Cc1cc(nc2c1cccc2)C=CC(C)O AIFCHEM-6379949632 [0,1,0,0,0,0|3,0,0]=4 8 B17R2.56295 OCC=Cc1cc(c2cc(ccc2c1)O)F AIFCHEM-6227090355 [0,1,0,0,0,0|3,0,0]=4 9 B14R1.476 CCCCC=Cc1ccccc1C=O AIFCHEM-6292270280 [1,0,1,0,0,0|0,0,2]=4 10 B14R2.112 CC=Cc1ccc2ccncc2c1 AIFCHEM-6471266307 [2,0,0,0,0,0|2,0,0]=4 11 B14R2.112 CC=Cc1cnc2ccccc2c1 AIFCHEM-6417161046 [2,0,0,0,0,0|2,0,0]=4 12 B14R2.112 CCNc1cc2ccccc2cn1 AIFCHEM-94537419260 [2,0,0,0,0,0|2,0,0]=4 13 B16R2.477 CC(O)C=Cc1ccc2ccccc2n1 AIFCHEM-94545473158 [1,1,0,0,0,0|2,0,0]=4 14 B16R2.1056 OCC=Cc1cc2ccccc2cc1O AIFCHEM-6458073314 [1,1,0,0,0,0|2,0,0]=4 15 B16R2.2441 CCCC=Cc1cc2ccccc2cn1 AIFCHEM-6457537568 [1,1,0,0,0,0|1,0,0]=3 16 B16R2.2441 CCOC=Cc1cc2ccccc2cn1 AIFCHEM-6427363409 [1,1,0,0,0,0|1,0,0]=3 17 B16R2.2441 CCOC=Cc1cnc2ccccc2c1 AIFCHEM-94580722499 [1,1,0,0,0,0|2,0,0]=4 18 B16R2.2441 COCC=Cc1ccc2ccccc2n1 AIFCHEM-6298282748 [1,1,0,0,0,0|2,0,0]=4 19 B16R2.24933 CC(=Cc1cc(c2ccccc2c1)O)C AIFCHEM-6453111564 [1,1,0,0,0,0|1,0,1]=4 20 B16R2.24933 CC(=Cc1cc2ccccc2c(=O)[nH]1)C AIFCHEM-6417480018 [1,1,0,0,0,0|1,0,0]=3 21 B16R2.24933 CC(=Cc1cc2ccccc2c(n1)N)C AIFCHEM-5595773140 [1,1,0,0,0,0|2,0,0]=4 22 B16R2.33887 C/C=C(\C)/c1cc2ccccc2c(=O)[nH]1 AIFCHEM-94584216368 [1,1,0,0,0,0|1,0,0]=3 23 B18R2.8958 O=C(O)c1cc(cc2c1cccc2)C=CCO AIFCHEM-6398948873 [0,2,0,0,0,0|2,0,0]=4 24 B18R2.75286 CCCCC=Cc1cc2ccccc2c(n1)N AIFCHEM-5603569476 [0,2,0,0,0,0|2,0,0]=4 25 B18R2.146216 CCCC=Cc1cc(c2cc(ccc2c1)O)F AIFCHEM-6191712907 [0,2,0,0,0,0|2,0,0]=4 26 B18R2.126200 CCN(C)C(=O)c1cc2ccccc2c(=O)[nH]1 AIFCHEM-94558974997 [0,2,0,0,0,0|2,0,0]=4 27 B16R2.150 OCC=Cc1cnc(o1)c2ccccc2 AIFCHEM-6293807597 [0,0,1,1,0,0|2,0,0]=4 28 B16R2.87 O=C(O)c1ccccc1c2cccnc2 AIFCHEM-94520920465 [0,0,1,1,0,0|1,0,1]=4 29 B18R3.6548 Nc1nc(cc2c1cccc2)C3=CCOC3 AIFCHEM-5646749507 [0,1,0,1,0,0|2,0,0]=4 30 B18R3.6548 Nc1nc(cc2c1cccc2)C3=COCC3 AIFCHEM-5628130045 [0,1,0,1,0,0|2,0,0]=4 31 B18R3.6548 O=c1[nH]c(cc2c1cccc2)C3=CCNC3 AIFCHEM-6431790309 [0,1,0,1,0,0|1,0,0]=3 32 B18R3.6548 O=c1[nH]c(cc2c1cccc2)C3=COCC3 AIFCHEM-6445929486 [0,1,0,1,0,0|1,0,0]=3 33 B18R3.6548 Oc1cc(cc2c1cccc2)C3=COCC3 AIFCHEM-6456472642 [0,1,0,1,0,0|1,0,1]=4 34 B18R3.100898 Nc1cc(cc2c1cccc2)C=C3CCC3 AIFCHEM-5797676024 [0,1,0,1,0,0|2,0,0]=4 35 B18R3.100899 O=c1[nH]c(cc2c1cccc2)C=CC3CC3 AIFCHEM-94569112643 [0,1,0,1,0,0|1,0,0]=3 36 B14R2.67 OCC=Cc1cc2ccccc2[nH]1 AIFCHEM-6357676558 [1,0,0,0,1,0|2,0,0]=4 37 B14R2.67 OCC=Cc1cc2ccccc2o1 AIFCHEM-6397308996 [1,0,0,0,1,0|1,0,0]=3 38 B16R2.12192 O=c1[nH]nc(c2c1cccc2)C=CCO AIFCHEM-6323421342 [0,0,0,0,1,1|2,0,0]=4