smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCc1c(C)nc(S[C@H](CCCC)C(=O)[O-])[n-]c1=O	ZINC000098048995	206545911	/nfs/dbraw/zinc/54/59/11/206545911.db2.gz	CKARLQCYAXWDHY-OAHLLOKOSA-N	-2	1	354.516	4.739	10	30		FJEEML
N#Cc1cc([O-])c(Br)c2ccc(-c3ccc([O-])c(F)c3)cc12	ZINC000013645160	211045671	/nfs/dbraw/zinc/04/56/71/211045671.db2.gz	DSGIEWLMQGUMOC-UHFFFAOYSA-N	-2	1	358.166	4.691	10	30		FJEEML
CCCCCCCc1c(C)nc(S[C@@H](CCCC)C(=O)[O-])[n-]c1=O	ZINC000098048994	222222608	/nfs/dbraw/zinc/22/26/08/222222608.db2.gz	CKARLQCYAXWDHY-HNNXBMFYSA-N	-2	1	354.516	4.739	10	30		FJEEML