smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1ccc(N[C@H](c2ccccc2)c2cc(Cl)c3cccnc3c2O)[nH+]c1 ZINC000045944526 212118314 /nfs/dbraw/zinc/11/83/14/212118314.db2.gz ASXQXISXNJMZSA-HXUWFJFHSA-N -1 2 375.859 5.499 40 10 GKCBLM Cc1ccc(N[C@@H](c2ccccc2)c2cc(Cl)c3cccnc3c2O)[nH+]c1 ZINC000045944522 212118051 /nfs/dbraw/zinc/11/80/51/212118051.db2.gz ASXQXISXNJMZSA-FQEVSTJZSA-N -1 2 375.859 5.499 40 10 GKCBLM