smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name COc1ccccc1NNC=C1C(=O)NC(=O)NC1=O ZINC000003090896 351311880 /nfs/dbraw/zinc/31/18/80/351311880.db2.gz HFICYZWZFYFTNZ-UHFFFAOYSA-N 0 2 276.252 -0.138 40 10 CBCBLN O=C1NC(=O)N(c2ccccc2)C(=O)C1=CNc1nn[nH]n1 ZINC000005603841 351323549 /nfs/dbraw/zinc/32/35/49/351323549.db2.gz NCKSVFJFEPMPQU-VURMDHGXSA-N 0 2 299.250 -0.222 40 10 CBCBLN O=C(Cc1ccc(O)cc1)NC=C1C(=O)NC(=O)NC1=O ZINC000006495079 170207388 /nfs/dbraw/zinc/20/73/88/170207388.db2.gz LHKHCMKBDRFWLC-UHFFFAOYSA-N 0 2 289.247 -0.699 40 10 CBCBLN