smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])Cc1c2cc(Cl)ccc2[nH]c1-c1ccc(F)cc1 ZINC000003755254 181044747 /nfs/dbraw/zinc/04/47/47/181044747.db2.gz SZBOOMYXDXCDSI-UHFFFAOYSA-N -1 2 303.720 4.255 50 0 DIAALM CC(C)CC[N@H+](Cn1nc(-c2cccs2)[nH]c1=S)C1CC1 ZINC000048344351 563697000 /nfs/dbraw/zinc/69/70/00/563697000.db2.gz NPPUMBMKSOBIRY-UHFFFAOYSA-N -1 2 322.503 4.137 50 0 DIAALM