smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name O=C([O-])c1cn(C2CC2)c2cc(N3CC[NH+](Cc4ccccc4)CC3)c(F)cc2c1=O ZINC000005934187 132308692 /nfs/dbraw/zinc/30/86/92/132308692.db2.gz ZEIULIVASNZVPU-UHFFFAOYSA-N 0 2 421.472 3.496 1 0 HGAFLN COc1ccc(C(O)=C(C(=O)C(=O)Nc2nccs2)c2ccc(OC)cc2)cc1 ZINC000102915899 559153503 /nfs/dbraw/zinc/15/35/03/559153503.db2.gz UPSWIRQXQLGRDS-KRWDZBQOSA-N 0 2 410.451 3.335 1 0 HGAFLN COc1ccc(C(O)=C(C(=O)C(=O)Nc2nccs2)c2ccc(OC)cc2)cc1 ZINC000102915901 559153447 /nfs/dbraw/zinc/15/34/47/559153447.db2.gz UPSWIRQXQLGRDS-QGZVFWFLSA-N 0 2 410.451 3.335 1 0 HGAFLN