smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C=CCn1c2c(nc(N)[n-]c2=O)n([C@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1=S	ZINC000027106992	206254044	/nfs/dbraw/zinc/25/40/44/206254044.db2.gz	JEOJPSUWQLWEMN-JFEMGPMLSA-N	-1	1	385.402	-2.004	1	30		GAEFMM
C=CCn1c2c(nc(N)[n-]c2=O)n([C@@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1=S	ZINC000027106995	206252951	/nfs/dbraw/zinc/25/29/51/206252951.db2.gz	JEOJPSUWQLWEMN-PXYVEVNBSA-N	-1	1	385.402	-2.004	1	30		GAEFMM
C=CCn1c2c(nc(N)[n-]c2=O)n([C@H]2O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c1=S	ZINC000027106997	212108058	/nfs/dbraw/zinc/10/80/58/212108058.db2.gz	JEOJPSUWQLWEMN-RTRHYMQASA-N	-1	1	385.402	-2.004	1	30		GAEFMM
O=C1[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)Oc2cc(Cl)ccc2N1[O-]	ZINC000095910132	291093128	/nfs/dbraw/zinc/09/31/28/291093128.db2.gz	XEGGMKDQOCMCAD-TWTZXXGESA-N	-1	1	377.733	-1.403	1	30	biogenic,in-vitro	GAEFMM