smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN1CCN(CC[NH2+]Cc2cc(I)cc(I)c2[O-])CC1	ZINC000048277660	554321425	/nfs/dbraw/zinc/32/14/25/554321425.db2.gz	IQITUQURQDSJGQ-UHFFFAOYSA-N	0	3	515.177	2.329	50	10		KECAHN
COc1ccc(N2CCN(Cc3c(O)c(=O)cc(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)n3C)CC2)cc1	ZINC000085879277	553689804	/nfs/dbraw/zinc/68/98/04/553689804.db2.gz	LEIKQKSMHODYDC-YADHBBJMSA-N	0	3	531.657	2.203	50	10	biogenic	KECAHN