smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CCCCCC(P(=O)([O-])O)[P@@](=O)([O-])O ZINC000013539382 581097918 /nfs/dbraw/zinc/09/79/18/581097918.db2.gz HOWTZHBAEIAYRZ-UHFFFAOYSA-N -2 2 246.136 1.248 1 0 BDAFLL CCCCCC(P(=O)([O-])O)[P@](=O)([O-])O ZINC000013539382 581097919 /nfs/dbraw/zinc/09/79/19/581097919.db2.gz HOWTZHBAEIAYRZ-UHFFFAOYSA-N -2 2 246.136 1.248 1 0 BDAFLL