smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cn1[n-]c(=O)c(=O)nc1SCC1=C(C(=O)[O-])N2C(=O)[C@H](N)[C@@H]2SC1	ZINC000002090292	483694130	/nfs/dbraw/zinc/69/41/30/483694130.db2.gz	YTUNICCSPPTMJY-RRAGMBSWSA-N	-2	1	371.400	-1.858	40	0		FAABML
Cn1[n-]c(=O)c(=O)nc1SCC1=C(C(=O)[O-])N2C(=O)[C@@H](N)[C@@H]2SC1	ZINC000016027484	482545089	/nfs/dbraw/zinc/54/50/89/482545089.db2.gz	YTUNICCSPPTMJY-FWOIEVBISA-N	-2	1	371.400	-1.446	40	0		FAABML
O=C([O-])CCNC(=O)CN(CC[NH+](CC(=O)[O-])CC(=O)[O-])CC(=O)[O-]	ZINC000022942302	482549232	/nfs/dbraw/zinc/54/92/32/482549232.db2.gz	AJUKWYKWYHXJGM-UHFFFAOYSA-N	-3	1	363.323	-2.565	40	0		FAABML
CS(=O)(=O)C(C1=Nc2n[n-]c(=N)n2C1=O)C1=Nc2n[n-]c(=N)n2C1=O	ZINC000104247811	222354608	/nfs/dbraw/zinc/35/46/08/222354608.db2.gz	FVEVBOKZCLAIGB-UHFFFAOYSA-N	-2	1	364.307	-2.739	40	0		FAABML