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(CCCCCCC(=O)Nc1cccc(-n2cc(C3CCCCC3)nn2)c1)N[O-]	ZINC000049070720	581101965	/nfs/dbraw/zinc/10/19/65/581101965.db2.gz	SGTCWQOXXQUYHN-UHFFFAOYSA-N	-1	3	413.522	4.100	1	30		HIEFHM
COc1ccc2c(c1)c1c3c(c4c5ccccc5n(C)c4c1n2CCC#N)C(=O)[N-]C3=O	ZINC000014944030	581097347	/nfs/dbraw/zinc/09/73/47/581097347.db2.gz	ZVNYZPSVRMHUSE-UHFFFAOYSA-N	-1	3	422.444	4.245	1	30		HIEFHM
O=C(CCCCCCC(=O)Nc1cccc(-c2cn(C3CCCCC3)nn2)c1)N[O-]	ZINC000049070553	581101993	/nfs/dbraw/zinc/10/19/93/581101993.db2.gz	XPQULOSXGAVNNQ-UHFFFAOYSA-N	-1	3	413.522	4.235	1	30		HIEFHM
CC(=O)C1=CCn2c3ccccc3c3c4c(c5c6ccccc6n(c5c32)C1)C(=O)[N-]C4=O	ZINC000042989957	581095819	/nfs/dbraw/zinc/09/58/19/581095819.db2.gz	NYZNNKMKRXQWHA-UHFFFAOYSA-N	-1	3	419.440	4.315	1	30		HIEFHM