smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=S(=O)(Nc1cc(O)cc(F)c1)c1c(Cl)cc(F)cc1Cl ZINC000435488349 943444392 /nfs/dbraw/zinc/44/43/92/943444392.db2.gz ZDRIMBRMAGQIOG-UHFFFAOYSA-N -2 2 354.161 3.778 20 0 FHADLL