smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(OC(=O)c2sc3nc4c(c(-c5ccco5)c3c2N)C[N@H+](C)CC4)cc1	ZINC000040570175	525369885	/nfs/dbraw/zinc/36/98/85/525369885.db2.gz	LYIPCRZXZDWNOL-UHFFFAOYSA-N	1	2	419.506	4.654	10	10		HJCELO
Cc1ccc(OC(=O)c2sc3nc4c(c(-c5ccco5)c3c2N)C[N@@H+](C)CC4)cc1	ZINC000040570175	525369893	/nfs/dbraw/zinc/36/98/93/525369893.db2.gz	LYIPCRZXZDWNOL-UHFFFAOYSA-N	1	2	419.506	4.654	10	10		HJCELO
Cc1ccccc1OC(=O)c1sc2nc3c(c(-c4ccco4)c2c1N)C[N@H+](C)CC3	ZINC000040570173	525276634	/nfs/dbraw/zinc/27/66/34/525276634.db2.gz	PAGYOPXUKDJTEC-UHFFFAOYSA-N	1	2	419.506	4.654	10	10		HJCELO
Cc1ccccc1OC(=O)c1sc2nc3c(c(-c4ccco4)c2c1N)C[N@@H+](C)CC3	ZINC000040570173	525276648	/nfs/dbraw/zinc/27/66/48/525276648.db2.gz	PAGYOPXUKDJTEC-UHFFFAOYSA-N	1	2	419.506	4.654	10	10		HJCELO