smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](Oc1ccc(O[P@@](=O)([O-])O)cc1)C1=CC=C[CH]1 ZINC001234331612 779215361 /nfs/dbraw/zinc/21/53/61/779215361.db2.gz IAIPUTLFZLQYJN-JTQLQIEISA-N -2 2 281.224 2.626 20 0 CFADLL C[C@H](Oc1ccc(O[P@](=O)([O-])O)cc1)C1=CC=C[CH]1 ZINC001234331612 779215363 /nfs/dbraw/zinc/21/53/63/779215363.db2.gz IAIPUTLFZLQYJN-JTQLQIEISA-N -2 2 281.224 2.626 20 0 CFADLL C[C@@H](Oc1ccc(O[P@@](=O)([O-])O)cc1)C1=CC=C[CH]1 ZINC001234331622 779215676 /nfs/dbraw/zinc/21/56/76/779215676.db2.gz IAIPUTLFZLQYJN-SNVBAGLBSA-N -2 2 281.224 2.626 20 0 CFADLL C[C@@H](Oc1ccc(O[P@](=O)([O-])O)cc1)C1=CC=C[CH]1 ZINC001234331622 779215681 /nfs/dbraw/zinc/21/56/81/779215681.db2.gz IAIPUTLFZLQYJN-SNVBAGLBSA-N -2 2 281.224 2.626 20 0 CFADLL O=C(Nc1ccncc1O)c1cc(F)cc(Cl)c1O ZINC000134047958 394187861 /nfs/dbraw/zinc/18/78/61/394187861.db2.gz LYMKNMIUWHHEOJ-UHFFFAOYSA-N -2 2 282.658 2.538 20 0 CFADLL