smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCn1cc[n+](CC(O)(P(=O)([O-])O)[P@@](=O)([O-])O)c1	ZINC000095590725	208236744	/nfs/dbraw/zinc/23/67/44/208236744.db2.gz	AZKPHAACXOXPFR-UHFFFAOYSA-O	-1	2	385.314	1.138	1	30	in-vitro	GDEFLM
CCCCCCCCn1cc[n+](CC(O)(P(=O)([O-])O)[P@](=O)([O-])O)c1	ZINC000095590725	208236749	/nfs/dbraw/zinc/23/67/49/208236749.db2.gz	AZKPHAACXOXPFR-UHFFFAOYSA-O	-1	2	385.314	1.138	1	30	in-vitro	GDEFLM
C=CCNC(=S)NS(=O)(=O)c1ccc(-n2nc(C(=O)[O-])cc2C)cc1	ZINC000169336432	209184236	/nfs/dbraw/zinc/18/42/36/209184236.db2.gz	STFKKFDXQKMQFK-UHFFFAOYSA-N	-1	2	380.451	1.218	1	30		GDEFLM
CCCCCCC#Cc1ccc[n+](CC(P(=O)([O-])O)[P@@](=O)([O-])O)c1	ZINC000049881604	222003207	/nfs/dbraw/zinc/00/32/07/222003207.db2.gz	AGSIJQACQLIDMB-UHFFFAOYSA-O	-1	2	376.306	1.978	1	30		GDEFLM
CCCCCCC#Cc1ccc[n+](CC(P(=O)([O-])O)[P@](=O)([O-])O)c1	ZINC000049881604	222003211	/nfs/dbraw/zinc/00/32/11/222003211.db2.gz	AGSIJQACQLIDMB-UHFFFAOYSA-O	-1	2	376.306	1.978	1	30		GDEFLM