smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[NH+](C)[C@@H](CNC(=O)NCc1ccc(O)c(F)c1)c1c(F)cccc1F ZINC000160122454 508941361 /nfs/dbraw/zinc/94/13/61/508941361.db2.gz WIPJEOXDXFELOC-HNNXBMFYSA-N -1 2 367.371 2.912 20 70 FFIDLM O=C(c1ccc(O)cc1)N1CC[NH+](CCOc2cccc(Cl)c2)CC1 ZINC000161397947 509111532 /nfs/dbraw/zinc/11/15/32/509111532.db2.gz SOOWSRYMTCRYIU-UHFFFAOYSA-N -1 2 360.841 2.882 20 70 FFIDLM C[NH+](C)[C@H](CNC(=O)NCc1ccc(O)c(F)c1)c1c(F)cccc1F ZINC000160122583 508941317 /nfs/dbraw/zinc/94/13/17/508941317.db2.gz WIPJEOXDXFELOC-OAHLLOKOSA-N -1 2 367.371 2.912 20 70 FFIDLM