smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CSc1ccc([C@H](C)NCc2c(C)c3ccccc3n2C)cc1 ZINC000391454931 333514494 /nfs/dbraw/zinc/51/44/94/333514494.db2.gz WRIVEGLCBBHUMF-HNNXBMFYSA-N 0 3 324.493 5.059 20 10 DKCDHN CSc1ccc([C@@H](C)NCc2c(C)c3ccccc3n2C)cc1 ZINC000391454936 333514403 /nfs/dbraw/zinc/51/44/03/333514403.db2.gz WRIVEGLCBBHUMF-OAHLLOKOSA-N 0 3 324.493 5.059 20 10 DKCDHN Cc1c2ccccc2n(C)c1CN[C@@H](C)c1csc(Cl)c1 ZINC000479456883 339536057 /nfs/dbraw/zinc/53/60/57/339536057.db2.gz ULQIQVFXKPHBJU-LBPRGKRZSA-N 0 3 318.873 5.052 20 10 DKCDHN