0 B22R3.1325097 Cc1ccc(c(c1)C=O)c2ccc(cc2)C3=NCCO3 AIFCHEM-6454350459 [0,0,0,0,0,0|4,0,0]=4 1 B22R3.1325097 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3cn[nH]c3 AIFCHEM-6408733375 [0,0,0,0,0,0|3,0,1]=4 2 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3ncc[nH]3)O AIFCHEM-6432501677 [0,0,0,0,0,0|3,0,0]=3 3 B22R3.1325097 O=Cc1cc(ccc1c2ccc(cc2)c3ncco3)F AIFCHEM-6289345836 [0,0,0,0,0,0|3,1,0]=4 4 B21R3.120 CCc1ccccc1c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6364764115 [1,0,0,0,0,0|2,0,1]=4 5 B21R3.120 O=Cc1ccccc1c2ccc(cc2)c3cnco3 AIFCHEM-6322137705 [1,0,0,0,0,0|3,0,0]=4 6 B21R3.120 O=Cc1ccccc1c2ccc(cc2)c3nnco3 AIFCHEM-6402010311 [1,0,0,0,0,0|2,0,0]=3 7 B21R3.120 OCc1ccccc1c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6290860368 [1,0,0,0,0,0|1,0,2]=4 8 B21R3.241 Cc1ccc(c(c1)N)c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6307106286 [1,0,0,0,0,0|3,0,0]=4 9 B23R3.730 Cc1cc(cc(c1c2ccc(cc2)c3nn[nH]n3)C=O)F AIFCHEM-94601764584 [0,1,0,0,0,0|0,1,2]=4 10 B23R3.730 Cc1cc(cc(c1c2ccc(cc2)c3nnco3)C=O)F AIFCHEM-94601765156 [0,1,0,0,0,0|2,1,0]=4 11 B23R3.730 O=Cc1cc(cc(c1c2ccc(cc2)c3nnco3)F)F AIFCHEM-6403939041 [0,1,0,0,0,0|2,1,0]=4 12 B23R3.87538 COc1ccc(c(c1)C=O)c2ccc(cc2)n3cnnn3 AIFCHEM-6312106766 [0,1,0,0,0,0|3,0,0]=4 13 B23R3.1597910 Cc1cc(c(cc1F)C=O)c2ccc(cc2)c3nnco3 AIFCHEM-6342112501 [0,1,0,0,0,0|2,1,0]=4 14 B23R3.1787427 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3nnc(o3)C AIFCHEM-6360272710 [0,1,0,0,0,0|3,0,0]=4 15 B23R3.1787427 Cc1ccc(c(c1)C=O)c2ccc(cc2)c3noc(=O)[nH]3 AIFCHEM-94524781437 [0,1,0,0,0,0|3,0,0]=4 16 B23R3.1787427 Cc1nnc(o1)c2ccc(cc2)c3ccc(cc3C=O)F AIFCHEM-6461555114 [0,1,0,0,0,0|2,1,0]=4 17 B23R3.2001300 O=Cc1cc(ccc1c2ccc(c(c2)F)c3ncc[nH]3)F AIFCHEM-94577649309 [0,1,0,0,0,0|2,1,0]=4 18 B23R3.2001300 O=Cc1cc(ccc1c2ccc(c(c2)O)c3ncc[nH]3)O AIFCHEM-6318927343 [0,1,0,0,0,0|3,0,0]=4 19 B21R3.3537 O=Cc1cc(ccc1c2ccc(s2)c3nnn[nH]3)O AIFCHEM-94588158256 [0,0,0,0,1,0|2,0,0]=3 20 B23R3.87332 O=Cc1cc(ccc1c2ccc(cc2)c3cncnc3)F AIFCHEM-6349381105 [0,0,0,0,0,1|2,1,0]=4 21 B20R3.166 Oc1ccccc1c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6364764248 [2,0,0,0,0,0|1,0,1]=4 22 B20R3.9 Nc1ccc(cc1)c2ccc(cc2)c3ncn[nH]3 AIFCHEM-94535584057 [2,0,0,0,0,0|2,0,0]=4 23 B22R3.865 O=CNc1ccccc1c2ccc(cc2)c3nnco3 AIFCHEM-94518720874 [1,1,0,0,0,0|2,0,0]=4 24 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)c3ncc[nH]3)O AIFCHEM-6460566913 [1,1,0,0,0,0|2,0,0]=4 25 B22R3.3860 O=Cc1ccc(cc1c2ccc(cc2)n3cnnn3)O AIFCHEM-6378718635 [1,1,0,0,0,0|2,0,0]=4 26 B22R3.59496 O=Cc1cccc(c1c2ccc(cc2)c3nnco3)F AIFCHEM-6479131327 [1,1,0,0,0,0|2,0,0]=4 27 B22R3.69682 O=Cc1ccccc1c2ccc(c(c2)O)c3ncc[nH]3 AIFCHEM-6358773259 [1,1,0,0,0,0|2,0,0]=4 28 B22R3.143227 O=Cc1c(cccc1c2ccc(cc2)c3ccn[nH]3)F AIFCHEM-6334961704 [1,1,0,0,0,0|2,0,0]=4 29 B22R3.32330 Oc1cc(c(cc1F)c2ccc(cc2)c3nnn[nH]3)F AIFCHEM-94586668881 [1,1,0,0,0,0|2,0,0]=4 30 B22R3.60536 COc1ccc(c(c1)C=O)c2ccc(s2)c3nnn[nH]3 AIFCHEM-94588159356 [0,1,0,0,1,0|2,0,0]=4 31 B22R3.631 Fc1ccccc1C=Cc2ccc(cc2)c3nnn[nH]3 AIFCHEM-94569703676 [0,0,1,1,0,0|1,1,0]=4 32 B22R3.3359366 Cc1ccc(c(c1)C=O)c2ccc3c(ncnc3c2)N AIFCHEM-5695142159 [0,0,1,1,0,0|2,0,0]=4 33 B22R4.280342 O=C1c2ccccc2-c3c1cc(cc3)c4cn[nH]n4 AIFCHEM-6365794382 [1,0,0,1,0,0|1,0,1]=4 34 B20R3.86 O=Cc1sccc1c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6331537077 [1,0,0,0,1,0|2,0,0]=4 35 B22R3.166 O=Cc1ccccc1c2ccc(cc2)c3cncnc3 AIFCHEM-6335143804 [1,0,0,0,0,1|2,0,0]=4 36 B22R3.90 Cc1ccc(cc1C=O)c2ccc(cc2)c3ncn[nH]3 AIFCHEM-6364843392 [0,0,0,0,1,1|2,0,0]=4