smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C(=NC1CCCCC1)=NC1CCCCC1	ZINC000008585900	560209583	/nfs/dbraw/zinc/20/95/83/560209583.db2.gz	QOSSAOTZNIDXMA-UHFFFAOYSA-N	0	0	206.333	3.826	50	70	in-vitro,metabolite	BHIARN
C[SiH](C[Si](C)(C)C)C[Si](C)(C)C	ZINC000169817421	583852866	/nfs/dbraw/zinc/85/28/66/583852866.db2.gz	TYLBDZLHYORWJA-UHFFFAOYSA-N	0	0	218.565	3.598	50	70		BHIARN
CCCn1c2ccc(C(C)C)cc2sc1=N	ZINC000217430866	169609927	/nfs/dbraw/zinc/60/99/27/169609927.db2.gz	UAXMFSQFORNSHE-UHFFFAOYSA-N	0	0	234.368	3.716	50	70		BHIARN
Oc1ccc(-c2nccc(C3CCCC3)n2)cc1	ZINC000217462148	183266468	/nfs/dbraw/zinc/26/64/68/183266468.db2.gz	RVCXQPXWQCCJKI-UHFFFAOYSA-N	0	0	240.306	3.507	50	70		BHIARN
CSCCC(=O)OCCCC1CCCCC1	ZINC000218546320	385904155	/nfs/dbraw/zinc/90/41/55/385904155.db2.gz	DRPAMWNRKDYACX-UHFFFAOYSA-N	0	0	244.400	3.643	50	70		BHIARN