smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC(CCC)SCCCC(C)(C)C#N	ZINC000476453827	528001632	/nfs/dbraw/zinc/00/16/32/528001632.db2.gz	ABSCTPFZEQSNKK-UHFFFAOYSA-N	0	0	241.444	5.018	20	30		BKEDRN
CCC[C@@H](CC)SCCCCC(C)(C)C#N	ZINC000477035085	528925564	/nfs/dbraw/zinc/92/55/64/528925564.db2.gz	OMGJNHQEYQWNPS-CYBMUJFWSA-N	0	0	241.444	5.018	20	30		BKEDRN
CCC[C@H](CC)SCCCCC(C)(C)C#N	ZINC000477035098	528109486	/nfs/dbraw/zinc/10/94/86/528109486.db2.gz	OMGJNHQEYQWNPS-ZDUSSCGKSA-N	0	0	241.444	5.018	20	30		BKEDRN
CCC(CC)(CC)SCCCC(C)(C)C#N	ZINC000762974528	585440522	/nfs/dbraw/zinc/44/05/22/585440522.db2.gz	RQCVJQZZQKNJJI-UHFFFAOYSA-N	0	0	241.444	5.018	20	30		BKEDRN