smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(S(=O)(=O)N2C[C@@H](N(C)S(C)(=O)=O)C[C@@H]2C(=O)N[O-])cc1	ZINC000013835724	581097638	/nfs/dbraw/zinc/09/76/38/581097638.db2.gz	TZQQXIZDSZWWPC-GXFFZTMASA-N	-1	3	407.470	-0.776	1	30		HBEFHM
CC#CCOc1ccc(S(=O)(=O)N2CCS(=O)(=O)CC[C@@H]2C(=O)N[O-])cc1	ZINC000028331433	581093847	/nfs/dbraw/zinc/09/38/47/581093847.db2.gz	JKWHUKMFJPDCMY-OAHLLOKOSA-N	-1	3	416.477	-0.228	1	30		HBEFHM
CC#CCOc1ccc(S(=O)(=O)N2CCS(=O)(=O)CC[C@H]2C(=O)N[O-])cc1	ZINC000028331436	581093749	/nfs/dbraw/zinc/09/37/49/581093749.db2.gz	JKWHUKMFJPDCMY-HNNXBMFYSA-N	-1	3	416.477	-0.228	1	30		HBEFHM
C[C@H]1O[C@@H]([C@@H]2[C@H](O)C[C@H]3OC(c4ccc([O-])cc4)=CC(=O)[C@@H]3[C@H]2O)C[C@H](O)[C@H]1O	ZINC000095919063	291167880	/nfs/dbraw/zinc/16/78/80/291167880.db2.gz	GVMVIIXQVWEKAF-GEZMLBCSSA-N	-1	3	406.431	-0.042	1	30	biogenic,in-vitro	HBEFHM