smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1ccc(CN2[C@@H]3CS(=O)(=O)C[C@@H]3[NH2+][C@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000575424527	484542093	/nfs/dbraw/zinc/54/20/93/484542093.db2.gz	TWKOIQHIDFCTTF-BYNSBNAKSA-N	1	2	371.484	-0.995	40	10		FBCBLO
Nc1ccc(CN2[C@@H]3CS(=O)(=O)C[C@@H]3[NH2+][C@@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000575424531	484541891	/nfs/dbraw/zinc/54/18/91/484541891.db2.gz	TWKOIQHIDFCTTF-LXTVHRRPSA-N	1	2	371.484	-0.995	40	10		FBCBLO
Nc1ccc(CN2[C@H]3CS(=O)(=O)C[C@H]3[NH2+][C@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000575424533	484542752	/nfs/dbraw/zinc/54/27/52/484542752.db2.gz	TWKOIQHIDFCTTF-PYHGIMPFSA-N	1	2	371.484	-0.995	40	10		FBCBLO
Nc1ccc(CN2[C@H]3CS(=O)(=O)C[C@@H]3[NH2+][C@H]3CS(=O)(=O)C[C@H]32)cc1	ZINC000575424535	484541758	/nfs/dbraw/zinc/54/17/58/484541758.db2.gz	TWKOIQHIDFCTTF-ZQDZILKHSA-N	1	2	371.484	-0.995	40	10		FBCBLO