smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(CN1C(=O)CSC1=S)N[C@H]1[C@H](O)O[C@H](COS(=O)(=O)[O-])[C@@H](O)[C@@H]1O	ZINC001144852576	1068043720	/nfs/dbraw/zinc/04/37/20/1068043720.db2.gz	DXPVHRIVIDLGNF-GKKUVZKPSA-N	-1	0	432.454	-3.410	20	10		IACDRM
O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@@H](O)[C@H](O)[C@@H](COS(=O)(=O)[O-])O[C@@H]1O	ZINC001144852577	1068043608	/nfs/dbraw/zinc/04/36/08/1068043608.db2.gz	DXPVHRIVIDLGNF-JKKQVKPRSA-N	-1	0	432.454	-3.410	20	10		IACDRM
Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2NC(=O)c2cc(=O)n(-c3ccccc3)[n-]2)c(=O)n1	ZINC001147889603	1068059719	/nfs/dbraw/zinc/05/97/19/1068059719.db2.gz	MYPLOAAIORURGM-HALQFCHDSA-N	-1	0	428.405	-1.404	20	10		IACDRM
CN(C)c1ccc(/C=C/C(=O)N[C@@H]2[C@@H](O)[C@H](O)[C@@H](COS(=O)(=O)[O-])O[C@@H]2O)cc1	ZINC001180130302	1068073392	/nfs/dbraw/zinc/07/33/92/1068073392.db2.gz	HCUBGJCSLXOJNK-AOAYZYFPSA-N	-1	0	432.451	-1.491	20	10		IACDRM
CN(C)c1ccc(/C=C/C(=O)N[C@H]2[C@H](O)O[C@H](COS(=O)(=O)[O-])[C@@H](O)[C@@H]2O)cc1	ZINC001180130303	1068073467	/nfs/dbraw/zinc/07/34/67/1068073467.db2.gz	HCUBGJCSLXOJNK-MZQSRWGZSA-N	-1	0	432.451	-1.491	20	10		IACDRM