smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOc1nc(NC)nc(NC(=O)[N-]S(=O)(=O)c2ccccc2C(=O)[O-])n1	ZINC000021984182	570300793	/nfs/dbraw/zinc/30/07/93/570300793.db2.gz	IRLGCAJYYKDTCG-UHFFFAOYSA-N	-2	1	396.385	0.725	40	30		GCEBML
CCOc1nc(NC)nc(NC(=O)N=S(=O)([O-])c2ccccc2C(=O)[O-])n1	ZINC000021984182	570300794	/nfs/dbraw/zinc/30/07/94/570300794.db2.gz	IRLGCAJYYKDTCG-UHFFFAOYSA-N	-2	1	396.385	0.725	40	30		GCEBML
COc1nc(C)nc(N(C)C(=O)[N-]S(=O)(=O)c2ccccc2C(=O)[O-])n1	ZINC000026893058	207320394	/nfs/dbraw/zinc/32/03/94/207320394.db2.gz	BQZXUHDXIARLEO-UHFFFAOYSA-N	-2	1	381.370	0.626	40	30	in-vitro	GCEBML
COc1nc(C)nc(N(C)C(=O)N=S(=O)([O-])c2ccccc2C(=O)[O-])n1	ZINC000026893058	207320397	/nfs/dbraw/zinc/32/03/97/207320397.db2.gz	BQZXUHDXIARLEO-UHFFFAOYSA-N	-2	1	381.370	0.626	40	30	in-vitro	GCEBML