smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCC[C@@H](CCCC)C(O)(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000005973105 581096910 /nfs/dbraw/zinc/09/69/10/581096910.db2.gz WVPPATHVDSBURI-LLVKDONJSA-N -2 2 346.297 2.765 1 0 EFAFLL CCCCCC[C@@H](CCCC)C(O)(P(=O)([O-])O)[P@](=O)([O-])O ZINC000005973105 581096911 /nfs/dbraw/zinc/09/69/11/581096911.db2.gz WVPPATHVDSBURI-LLVKDONJSA-N -2 2 346.297 2.765 1 0 EFAFLL CCCCCC[C@H](CCCC)C(O)(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000005973139 581096829 /nfs/dbraw/zinc/09/68/29/581096829.db2.gz WVPPATHVDSBURI-NSHDSACASA-N -2 2 346.297 2.765 1 0 EFAFLL CCCCCC[C@H](CCCC)C(O)(P(=O)([O-])O)[P@](=O)([O-])O ZINC000005973139 581096830 /nfs/dbraw/zinc/09/68/30/581096830.db2.gz WVPPATHVDSBURI-NSHDSACASA-N -2 2 346.297 2.765 1 0 EFAFLL