smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CNc1ccc2cc3ccc(N(C)S(C)(=O)=O)cc3[nH+]c2c1CO	ZINC000028017284	202164150	/nfs/dbraw/zinc/16/41/50/202164150.db2.gz	NHPXFGHIVOZMLY-UHFFFAOYSA-N	1	1	345.424	2.318	1	5		EEBFMO
Cc1[nH+]ccn1-c1nc(NC[C@H]2CCCCO2)nc(C)c1[N+](=O)[O-]	ZINC000028821472	202177676	/nfs/dbraw/zinc/17/76/76/202177676.db2.gz	LWYCLEOURKNTGE-GFCCVEGCSA-N	1	1	332.364	2.168	1	5		EEBFMO
Cc1[nH+]ccn1-c1nc(N[C@H]2CCCO[C@H]2C)nc(C)c1[N+](=O)[O-]	ZINC000028821489	202177547	/nfs/dbraw/zinc/17/75/47/202177547.db2.gz	MUVKLQALFDQZKH-JQWIXIFHSA-N	1	1	332.364	2.167	1	5		EEBFMO
Cc1[nH+]ccn1-c1nc(N[C@@H]2CCCO[C@H]2C)nc(C)c1[N+](=O)[O-]	ZINC000028821491	202177824	/nfs/dbraw/zinc/17/78/24/202177824.db2.gz	MUVKLQALFDQZKH-CMPLNLGQSA-N	1	1	332.364	2.167	1	5		EEBFMO
Cc1[nH+]ccn1-c1nc(NC2CCSCC2)nc(C)c1[N+](=O)[O-]	ZINC000028821469	202178002	/nfs/dbraw/zinc/17/80/02/202178002.db2.gz	WCOGTFNZOYDKQP-UHFFFAOYSA-N	1	1	334.405	2.495	1	5		EEBFMO