smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Oc1c(Cl)cccc1C[NH2+][C@@H](c1ccco1)c1ccccc1 ZINC000181029714 333029533 /nfs/dbraw/zinc/02/95/33/333029533.db2.gz LAXHPDPGDHMSED-QGZVFWFLSA-N -1 2 313.784 4.518 20 10 DJCDLM Oc1c(Cl)cccc1C[NH2+][C@H](c1ccco1)c1ccccc1 ZINC000181029696 333029552 /nfs/dbraw/zinc/02/95/52/333029552.db2.gz LAXHPDPGDHMSED-KRWDZBQOSA-N -1 2 313.784 4.518 20 10 DJCDLM