smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCCCCCCOCCOCCOCCO[P@@](=O)([O-])O ZINC000100097400 520011077 /nfs/dbraw/zinc/01/10/77/520011077.db2.gz JQAGDVDTMKMJIR-UHFFFAOYSA-N -1 2 398.477 4.066 10 30 GIEELM CCCCCCCCCCCCOCCOCCOCCO[P@](=O)([O-])O ZINC000100097400 520011084 /nfs/dbraw/zinc/01/10/84/520011084.db2.gz JQAGDVDTMKMJIR-UHFFFAOYSA-N -1 2 398.477 4.066 10 30 GIEELM