smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(OC)c([C@H]2CC(c3c(=O)[nH]c(=S)n(C)c3O)=NN2C(C)=O)c1	ZINC000101764449	560801033	/nfs/dbraw/zinc/80/10/33/560801033.db2.gz	IBZVLSSSNVKULC-CYBMUJFWSA-N	-2	2	404.448	1.863	50	0		HDAALL
Cc1csc(=Nc2ccccc2)n1CCC(O)(P(=O)([O-])O)[P@@](=O)([O-])O	ZINC000003055228	557793251	/nfs/dbraw/zinc/79/32/51/557793251.db2.gz	FCUHCHBZXAIVLY-UHFFFAOYSA-O	-2	2	409.317	1.479	50	0		HDAALL
Cc1csc(=Nc2ccccc2)n1CCC(O)(P(=O)([O-])O)[P@](=O)([O-])O	ZINC000003055228	557793254	/nfs/dbraw/zinc/79/32/54/557793254.db2.gz	FCUHCHBZXAIVLY-UHFFFAOYSA-O	-2	2	409.317	1.479	50	0		HDAALL
COc1ccc(OC)c([C@@H]2CC(c3c(=O)[nH]c(=S)n(C)c3O)=NN2C(C)=O)c1	ZINC000101764447	560801106	/nfs/dbraw/zinc/80/11/06/560801106.db2.gz	IBZVLSSSNVKULC-ZDUSSCGKSA-N	-2	2	404.448	1.863	50	0		HDAALL
O=P([O-])(O)c1ccccc1NCCCCCNc1ccccc1[P@](=O)([O-])O	ZINC000002770450	568931989	/nfs/dbraw/zinc/93/19/89/568931989.db2.gz	LSBKBUCTOTZUSC-UHFFFAOYSA-N	-2	2	414.335	1.987	50	0		HDAALL
O=P([O-])(O)c1ccccc1NCCCCCNc1ccccc1[P@@](=O)([O-])O	ZINC000002770450	568931991	/nfs/dbraw/zinc/93/19/91/568931991.db2.gz	LSBKBUCTOTZUSC-UHFFFAOYSA-N	-2	2	414.335	1.987	50	0		HDAALL