smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1c2c(O)ccc(O)c2C(=O)c2c(NCC[NH2+]CCO)ccc(NCC[NH2+]CO)c21	ZINC000028761620	563063773	/nfs/dbraw/zinc/06/37/73/563063773.db2.gz	ZGKTVSBCLLURMJ-UHFFFAOYSA-N	2	0	430.461	-0.182	1	10		IBCFRP
O=C(C[NH2+]CCO)Nc1ccc(NC(=O)C[NH2+]CCO)c2c1C(=O)c1ccccc1C2=O	ZINC000029569004	563082826	/nfs/dbraw/zinc/08/28/26/563082826.db2.gz	YOABGVBDWMDJRH-UHFFFAOYSA-N	2	0	440.456	-0.497	1	10		IBCFRP
O=C1c2c(O)ccc(NCC[NH2+]CCO)c2C(=O)c2c(NCC[NH2+]CCO)ccc(O)c21	ZINC000045284841	563128122	/nfs/dbraw/zinc/12/81/22/563128122.db2.gz	SGQNGVCOSWPQHG-UHFFFAOYSA-N	2	0	444.488	-0.139	1	10		IBCFRP
[NH3+]CCNCCNc1ccc(NCC[NH2+]CCO)c2c1C(=O)c1c(O)ccc(O)c1C2=O	ZINC000045287501	563128454	/nfs/dbraw/zinc/12/84/54/563128454.db2.gz	AYJYLOQYOYLSTL-UHFFFAOYSA-N	2	0	443.504	-0.173	1	10		IBCFRP