smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCC[NH3+])C(N)=O	ZINC000013610484	221276503	/nfs/dbraw/zinc/27/65/03/221276503.db2.gz	HAJZWFHKMBYLNN-ULQDDVLXSA-N	1	3	391.516	-0.204	1	0		GBAFHO
CC(C)C[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@@H]([NH2+]CC(N)=O)C1	ZINC000084707629	205399259	/nfs/dbraw/zinc/39/92/59/205399259.db2.gz	NPNVBNQAFUBNRX-PMPSAXMXSA-N	1	3	383.537	-0.043	1	0		GBAFHO
CC(C)C[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]([NH2+]CC(N)=O)C1	ZINC000084707714	205398478	/nfs/dbraw/zinc/39/84/78/205398478.db2.gz	NPNVBNQAFUBNRX-JYJNAYRXSA-N	1	3	383.537	-0.043	1	0		GBAFHO