smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)O[C@@H]2[C@@H](O1)[C@H](COS(C)(=O)=O)O[C@@H]2n1ncc(=O)[nH]c1=O	ZINC000035349229	482535748	/nfs/dbraw/zinc/53/57/48/482535748.db2.gz	WHZZSEDRSUGQAL-MCNGFCJOSA-N	0	2	363.348	-1.675	40	30		FAEBLN
CC1(C)O[C@@H]2[C@@H](COS(C)(=O)=O)O[C@H](n3ncc(=O)[nH]c3=O)[C@@H]2O1	ZINC000035349230	482535037	/nfs/dbraw/zinc/53/50/37/482535037.db2.gz	WHZZSEDRSUGQAL-QQRDMOCMSA-N	0	2	363.348	-1.675	40	30		FAEBLN
CC1(C)O[C@@H]2[C@@H](O1)[C@@H](COS(C)(=O)=O)O[C@@H]2n1ncc(=O)[nH]c1=O	ZINC000035349231	482536067	/nfs/dbraw/zinc/53/60/67/482536067.db2.gz	WHZZSEDRSUGQAL-NEPJDUFXSA-N	0	2	363.348	-1.675	40	30		FAEBLN