smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCC[S@@+](C)CC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000034803931	581094495	/nfs/dbraw/zinc/09/44/95/581094495.db2.gz	NYXTVKKWHZOSOD-DEOSSOPVSA-O	-1	2	405.454	3.837	10	30		HHEELM
CCCCCCCCCCCC[S@@+](C)CC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000034803931	581094496	/nfs/dbraw/zinc/09/44/96/581094496.db2.gz	NYXTVKKWHZOSOD-DEOSSOPVSA-O	-1	2	405.454	3.837	10	30		HHEELM
CCCCCCCCCCCC[S@+](C)CC(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000034803933	581094609	/nfs/dbraw/zinc/09/46/09/581094609.db2.gz	NYXTVKKWHZOSOD-XMMPIXPASA-O	-1	2	405.454	3.837	10	30		HHEELM
CCCCCCCCCCCC[S@+](C)CC(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000034803933	581094610	/nfs/dbraw/zinc/09/46/10/581094610.db2.gz	NYXTVKKWHZOSOD-XMMPIXPASA-O	-1	2	405.454	3.837	10	30		HHEELM