smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[NH3+]CCC(=O)NCCS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc32)cc1	ZINC000026841365	563036866	/nfs/dbraw/zinc/03/68/66/563036866.db2.gz	BFSXRRVPTIOSJL-UHFFFAOYSA-N	1	3	463.563	3.338	1	10		JGCFHO
COc1cc2c3c(n(CCC[NH+](C)C)c(=O)c2cc1OC)-c1ccc(OCCN(C)C)cc1C3=O	ZINC000040423645	563142449	/nfs/dbraw/zinc/14/24/49/563142449.db2.gz	SHOPZVOCDKSTGK-UHFFFAOYSA-N	1	3	479.577	3.122	1	10		JGCFHO
CCCCNCC(=O)Nc1ccc2c(c1)C(=O)c1cc(NC(=O)C[NH2+]CCCC)ccc1C2=O	ZINC000040954852	563160654	/nfs/dbraw/zinc/16/06/54/563160654.db2.gz	FYPZVYMKSUFNRS-UHFFFAOYSA-N	1	3	464.566	3.118	1	10	in-vivo	JGCFHO