smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=C[C@@H]([NH2+]CCSSC)C(=O)[O-]	ZINC000397803794	973022014	/nfs/dbraw/zinc/02/20/14/973022014.db2.gz	WAXKGKJNGRHDQB-ZCFIWIBFSA-N	0	0	207.320	1.226	10	50		BDGERN
CC[C@H]([NH2+]CCSSC)C(=O)[O-]	ZINC000397818785	973023890	/nfs/dbraw/zinc/02/38/90/973023890.db2.gz	DABLZUFCOHGFRB-LURJTMIESA-N	0	0	209.336	1.450	10	50		BDGERN
[CH2]S(=O)(=O)SCCCC[N+](C)(C)C	ZINC000103599150	717146936	/nfs/dbraw/zinc/14/69/36/717146936.db2.gz	IPNYNDPMXDBJAX-UHFFFAOYSA-N	0	0	225.379	1.327	10	50	in-vitro	BDGERN
CC[C@@H]([NH2+]CCSSC)C(=O)[O-]	ZINC000397818788	973024162	/nfs/dbraw/zinc/02/41/62/973024162.db2.gz	DABLZUFCOHGFRB-ZCFIWIBFSA-N	0	0	209.336	1.450	10	50		BDGERN
C=C[C@H]([NH2+]CCSSC)C(=O)[O-]	ZINC000397803792	973021820	/nfs/dbraw/zinc/02/18/20/973021820.db2.gz	WAXKGKJNGRHDQB-LURJTMIESA-N	0	0	207.320	1.226	10	50		BDGERN