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](Nc1cccc2ccccc21)c1cc(Cl)ccc1[O-] ZINC000000616857 567834244 /nfs/dbraw/zinc/83/42/44/567834244.db2.gz XQCMRFMFGNFTGL-LBPRGKRZSA-N -1 3 297.785 5.372 50 10 CKCAHM C[C@@H](Nc1cccc2ccccc21)c1cc(Cl)ccc1[O-] ZINC000000616859 567834423 /nfs/dbraw/zinc/83/44/23/567834423.db2.gz XQCMRFMFGNFTGL-GFCCVEGCSA-N -1 3 297.785 5.372 50 10 CKCAHM CCCCc1ccc(NCc2cc(Cl)ccc2[O-])cc1 ZINC000021809055 171328725 /nfs/dbraw/zinc/32/87/25/171328725.db2.gz VUAZFINKPNNVML-UHFFFAOYSA-N -1 3 289.806 5.000 50 10 CKCAHM