smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCCCCCCCCCCC[N+](C)(C)C[C@H](O)CCl	ZINC000095858340	717140238	/nfs/dbraw/zinc/14/02/38/717140238.db2.gz	XERREUIGCGXTDG-HSZRJFAPSA-N	1	0	391.104	6.924	10	50		GKGERO
CCCCC[N+](CCCCC)(CCCCC)CCCSS(C)(=O)=O	ZINC000006592231	717104623	/nfs/dbraw/zinc/10/46/23/717104623.db2.gz	SFGWAQFYSHKJSQ-UHFFFAOYSA-N	1	0	380.684	5.457	10	50	in-vitro	GKGERO
CCCC[N+](CCCC)(CCCC)CCCCCCCCBr	ZINC000006778754	717104796	/nfs/dbraw/zinc/10/47/96/717104796.db2.gz	OYBJHGWIIFRVBO-UHFFFAOYSA-N	1	0	377.475	6.939	10	50	in-vitro	GKGERO
CCCC[N+](CCCC)(CCCC)CCCCCCSS(C)(=O)=O	ZINC000077319678	717134652	/nfs/dbraw/zinc/13/46/52/717134652.db2.gz	WPZAATOXXPOCQJ-UHFFFAOYSA-N	1	0	380.684	5.457	10	50	in-vitro	GKGERO
CCCCCCCCCCCCCCCCCC[N+](C)(C)C[C@@H](O)CCl	ZINC000095858341	717140155	/nfs/dbraw/zinc/14/01/55/717140155.db2.gz	XERREUIGCGXTDG-QHCPKHFHSA-N	1	0	391.104	6.924	10	50		GKGERO
CC(C)C[N+](CCCCCCSS(C)(=O)=O)(CC(C)C)CC(C)C	ZINC000006693321	717104515	/nfs/dbraw/zinc/10/45/15/717104515.db2.gz	WXKBFCCTCBRVND-UHFFFAOYSA-N	1	0	380.684	5.024	10	50	in-vitro	GKGERO