smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc([C@]2(C[NH+](CC(=O)[O-])CC(=O)[O-])c3ccccc3OS2(=O)=O)c(C)c(C[NH+](CC(=O)[O-])CC(=O)[O-])c1O	ZINC000100127586	554225104	/nfs/dbraw/zinc/22/51/04/554225104.db2.gz	WMGSOHFRJURSQR-VWLOTQADSA-N	-2	2	580.568	0.417	40	10		KCCBLL
Cc1cc([C@@]2(C[NH+](CC(=O)[O-])CC(=O)[O-])c3ccccc3OS2(=O)=O)c(C)c(C[NH+](CC(=O)[O-])CC(=O)[O-])c1O	ZINC000100127591	554225025	/nfs/dbraw/zinc/22/50/25/554225025.db2.gz	WMGSOHFRJURSQR-RUZDIDTESA-N	-2	2	580.568	0.417	40	10		KCCBLL