smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1([NH2+]c2ccc(N)cc2)CCCC1	42176416	572007194	/nfs/dbraw/zinc/00/71/94/572007194.db2.gz	IWJOXDGQJFSGFJ-UHFFFAOYSA-N	1	2	190.290	3.013	10	10		AGCELO
CCCCCC[NH2+]c1ccc(N)cc1	66111180	572685938	/nfs/dbraw/zinc/68/59/38/572685938.db2.gz	IELAVJDOWOPAMD-UHFFFAOYSA-N	1	2	192.306	3.261	10	10		AGCELO
CCCNc1ccc(N=[NH2+])cc1	109064918	343753298	/nfs/dbraw/zinc/75/32/98/343753298.db2.gz	JFJBTKSABOWKKW-UHFFFAOYSA-N	1	2	163.224	3.171	10	10		AGCELO