smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)n1c([N-]N=C2C(=O)NC(=O)NC2=O)nc2c1c(=O)[nH]c(=O)n2C	ZINC000002413238	210396810	/nfs/dbraw/zinc/39/68/10/210396810.db2.gz	YZLVKAJNFOGAJA-UHFFFAOYSA-N	-1	1	362.306	-1.862	50	30		FAEAMM
Cn1c([N-]N=C2C(=O)N(C)C(=O)N(C)C2=O)nc2c1c(=O)[nH]c(=O)n2C	ZINC000009849203	483732048	/nfs/dbraw/zinc/73/20/48/483732048.db2.gz	USEXNQMDNAFFFT-UHFFFAOYSA-N	-1	1	362.306	-2.221	50	30		FAEAMM
C=CCn1c(=O)c2c(nc([N-]N=C3C(=O)NC(=O)NC3=O)n2C)n(C)c1=O	ZINC000010272112	204005925	/nfs/dbraw/zinc/00/59/25/204005925.db2.gz	VRBXXKJMXCSXCB-UHFFFAOYSA-N	-1	1	374.317	-2.246	50	30		FAEAMM
O=C1C(=O)C(O[C@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)=C([O-])c2ccccc21	ZINC000253503740	527128664	/nfs/dbraw/zinc/12/86/64/527128664.db2.gz	ZPZGPVPZOQHNJA-CRDBMLMKSA-N	-1	1	352.295	-1.348	50	30		FAEAMM
O=C1C(=O)C(O[C@@H]2O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)=C([O-])c2ccccc21	ZINC000253503742	527128417	/nfs/dbraw/zinc/12/84/17/527128417.db2.gz	ZPZGPVPZOQHNJA-XBJBOQPMSA-N	-1	1	352.295	-1.348	50	30		FAEAMM