smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(NCC[NH2+]CCO)c1ccc2c3c([nH]n2CC[NH+]2CCCC2)c2ccccc2[nH+]c31	ZINC000026994232	563038799	/nfs/dbraw/zinc/03/87/99/563038799.db2.gz	JETOGRHQRHXCGI-UHFFFAOYSA-N	3	1	434.544	2.078	1	5		IEBFMP
[NH3+]CC[NH2+]CCCn1c(=O)c2cc([N+](=O)[O-])ccc2c2cnc3cc4c(cc3c21)OCO4	ZINC000096932824	563198964	/nfs/dbraw/zinc/19/89/64/563198964.db2.gz	DVPVAUIERLLZCK-UHFFFAOYSA-N	2	1	435.440	2.278	1	5		IEBFMP
O=C(NCC[NH2+]CCO)c1ccc2c3c([nH]n2CC[NH+]2CCCCC2)c2ccccc2[nH+]c31	ZINC000026989140	563038704	/nfs/dbraw/zinc/03/87/04/563038704.db2.gz	DNHBVOJCWMPPOV-UHFFFAOYSA-N	3	1	448.571	2.468	1	5		IEBFMP