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)CC[NH2+]c1ccc(N)cc1	123818003	573195856	/nfs/dbraw/zinc/19/58/56/573195856.db2.gz	RUJYEQAVROFPQF-UHFFFAOYSA-N	1	1	192.306	3.117	20	10		AGCDMO
CCC(CC)C[NH2+]c1ccc(N)cc1	130204189	573480970	/nfs/dbraw/zinc/48/09/70/573480970.db2.gz	PCHXWOYQCJJBBA-UHFFFAOYSA-N	1	1	192.306	3.117	20	10		AGCDMO
CC(C)CCC[NH2+]c1ccc(N)cc1	62100320	630873845	/nfs/dbraw/zinc/87/38/45/630873845.db2.gz	RVKFVAZGNPTWNF-UHFFFAOYSA-N	1	1	192.306	3.117	20	10		AGCDMO