smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCCCSCC(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000095581138 185381215 /nfs/dbraw/zinc/38/12/15/185381215.db2.gz CGPFTXXMYYSRBQ-UHFFFAOYSA-N -2 2 320.284 2.372 1 30 DEEFLL CCCCCCCSCC(P(=O)([O-])O)[P@](=O)([O-])O ZINC000095581138 185381216 /nfs/dbraw/zinc/38/12/16/185381216.db2.gz CGPFTXXMYYSRBQ-UHFFFAOYSA-N -2 2 320.284 2.372 1 30 DEEFLL CCCCCCCCCC(O)(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000034803921 581096999 /nfs/dbraw/zinc/09/69/99/581096999.db2.gz NSCPCMXKWUFFNL-UHFFFAOYSA-N -2 2 318.243 2.129 1 30 in-vitro DEEFLL CCCCCCCCCC(O)(P(=O)([O-])O)[P@](=O)([O-])O ZINC000034803921 581097000 /nfs/dbraw/zinc/09/70/00/581097000.db2.gz NSCPCMXKWUFFNL-UHFFFAOYSA-N -2 2 318.243 2.129 1 30 in-vitro DEEFLL