smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COC(=O)CCc1cn([C@@H]2C[C@H](N=[N+]=[N-])[C@@H](CO)O2)c(=O)[nH]c1=O	ZINC000029569558	202189402	/nfs/dbraw/zinc/18/94/02/202189402.db2.gz	KVRUGZHZGPEWCE-AEJSXWLSSA-N	0	0	339.308	-0.399	1	10		EBCFRN
O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]1C[C@]2(O)C[C@@H](OC2=O)[C@@H]1O	ZINC000095617909	571796686	/nfs/dbraw/zinc/79/66/86/571796686.db2.gz	FXXATDNXMJKMSF-JUHZACGLSA-N	0	0	336.296	-0.166	1	10	endogenous,in-man	EBCFRN
NS(=O)(=O)c1cccc2c1c([N+](=O)[O-])cc1c2=CC(=O)C(=O)C=1	ZINC000027328989	212553668	/nfs/dbraw/zinc/55/36/68/212553668.db2.gz	SAIWRCQEDKJPAN-UHFFFAOYSA-N	0	0	332.293	-0.892	1	10		EBCFRN
CC(=O)N1Cc2c(O)c3c(cc2C2=C[C@H](O)[C@@H](O)[C@@H](O)[C@@H]21)OCO3	ZINC000040404835	213299177	/nfs/dbraw/zinc/29/91/77/213299177.db2.gz	DYKBYYDXVDDTJK-BTQDYEIMSA-N	0	0	335.312	-0.669	1	10		EBCFRN
O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1[C@H]2C[C@@](O)(C[C@H]1O)C(=O)O2	ZINC000095617910	571796657	/nfs/dbraw/zinc/79/66/57/571796657.db2.gz	BMSNCTFPYHTXGU-JUHZACGLSA-N	0	0	336.296	-0.166	1	10	endogenous,in-man	EBCFRN