smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cccc(N/N=C2/C(=O)[N-]C(=S)NC2=O)c1C(=O)[O-]	ZINC000038290813	395732048	/nfs/dbraw/zinc/73/20/48/395732048.db2.gz	UGXCATHNVKWPFN-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML
Cc1cccc(N/N=C2\C(=O)[N-]C(=S)NC2=O)c1C(=O)[O-]	ZINC000038290813	395732051	/nfs/dbraw/zinc/73/20/51/395732051.db2.gz	UGXCATHNVKWPFN-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML
O=c1[n-]c(=S)[nH]c([O-])c1N=Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000016385827	415156101	/nfs/dbraw/zinc/15/61/01/415156101.db2.gz	GDJSFOLPLIBWMI-UHFFFAOYSA-N	-3	1	309.263	0.440	40	30		DCEBML
Cc1ccc(C(=O)[O-])cc1N/N=C1/C(=O)[N-]C(=S)NC1=O	ZINC000038290758	395731763	/nfs/dbraw/zinc/73/17/63/395731763.db2.gz	PSHKSLAVOZSJPZ-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML
Cc1ccc(C(=O)[O-])cc1N/N=C1\C(=O)[N-]C(=S)NC1=O	ZINC000038290758	395731765	/nfs/dbraw/zinc/73/17/65/395731765.db2.gz	PSHKSLAVOZSJPZ-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML
Cc1cc(C(=O)[O-])ccc1N/N=C1/C(=O)[N-]C(=S)NC1=O	ZINC000038290757	301155135	/nfs/dbraw/zinc/15/51/35/301155135.db2.gz	VWDVHYMGCGLSKF-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML
Cc1cc(C(=O)[O-])ccc1N/N=C1\C(=O)[N-]C(=S)NC1=O	ZINC000038290757	301155137	/nfs/dbraw/zinc/15/51/37/301155137.db2.gz	VWDVHYMGCGLSKF-UHFFFAOYSA-N	-2	1	306.303	0.832	40	30		DCEBML