smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCOc1ccc(C[NH2+]CCC[NH+](CCCC)CCCC)cc1OCC	ZINC000013733652	519034694	/nfs/dbraw/zinc/03/46/94/519034694.db2.gz	KVWQXIUKGKAPPW-UHFFFAOYSA-N	2	1	376.585	5.032	10	30		GKEEMP
C=CCOc1c(Cl)cc(C[NH2+]CCC[NH+](CCCC)CCCC)cc1OC	ZINC000013733856	519003653	/nfs/dbraw/zinc/00/36/53/519003653.db2.gz	HELWTKOWQSQUNQ-UHFFFAOYSA-N	2	1	397.003	5.295	10	30		GKEEMP
C=CCc1cc(C[NH2+]CCC[NH+](CCCC)CCCC)cc(OC)c1OCC	ZINC000013734067	519131581	/nfs/dbraw/zinc/13/15/81/519131581.db2.gz	PWSJKTXZQRGNLP-UHFFFAOYSA-N	2	1	390.612	5.204	10	30		GKEEMP