smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCSCC(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000095585545 185381646 /nfs/dbraw/zinc/38/16/46/185381646.db2.gz MICBGHWLWMYXPJ-UHFFFAOYSA-N -2 2 306.257 1.981 1 0 DDAFLL CCCCCCSCC(P(=O)([O-])O)[P@](=O)([O-])O ZINC000095585545 185381647 /nfs/dbraw/zinc/38/16/47/185381647.db2.gz MICBGHWLWMYXPJ-UHFFFAOYSA-N -2 2 306.257 1.981 1 0 DDAFLL COC(=O)C[C@@H](C(C)=O)c1cc(=O)c2c(O)cc(O)cc2o1 ZINC000014691865 560224618 /nfs/dbraw/zinc/22/46/18/560224618.db2.gz LUSYBMBHUGHWAK-VIFPVBQESA-N -2 2 306.270 1.440 1 0 biogenic,in-vitro DDAFLL