smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(NS(=O)(=O)c2ccccc2)c(NS(=O)(=O)c2ccccc2)c1	ZINC000001037066	557151036	/nfs/dbraw/zinc/15/10/36/557151036.db2.gz	OXWNQQQDHOCNBE-UHFFFAOYSA-N	-2	2	402.497	3.597	50	0		HHAALL
CCCCn1c(O)c(C2=NN(C(C)=O)[C@H](c3ccc(Cl)cc3)C2)c(=O)[nH]c1=S	ZINC000101456093	560795389	/nfs/dbraw/zinc/79/53/89/560795389.db2.gz	APPRWOYPIYLXIJ-HNNXBMFYSA-N	-2	2	420.922	3.763	50	0		HHAALL
CCCCn1c(O)c(C2=NN(C(C)=O)[C@@H](c3ccc(Cl)cc3)C2)c(=O)[nH]c1=S	ZINC000101456095	560795337	/nfs/dbraw/zinc/79/53/37/560795337.db2.gz	APPRWOYPIYLXIJ-OAHLLOKOSA-N	-2	2	420.922	3.763	50	0		HHAALL
CCc1ccc(S(=O)(=O)Nc2ccc([N@@H+]3CCC[C@@H](C)C3)cc2C(=O)[O-])cc1	ZINC000033007344	568510139	/nfs/dbraw/zinc/51/01/39/568510139.db2.gz	AZSMGGBSAAQGLG-OAHLLOKOSA-N	-2	2	402.516	3.984	50	0		HHAALL