smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=P([O-])(O)CCOCCOCC[P@](=O)([O-])O ZINC000096308247 351774802 /nfs/dbraw/zinc/77/48/02/351774802.db2.gz WFYMNIPZKITWCE-UHFFFAOYSA-N -2 2 278.134 -0.625 40 0 CBABLL O=P([O-])(O)CCOCCOCC[P@@](=O)([O-])O ZINC000096308247 351774804 /nfs/dbraw/zinc/77/48/04/351774804.db2.gz WFYMNIPZKITWCE-UHFFFAOYSA-N -2 2 278.134 -0.625 40 0 CBABLL