smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([N-]S(=O)(=O)c2ccsc2C(=O)Nc2nnc(CCC(C)C)s2)cc1	ZINC001453375329	1067301963	/nfs/dbraw/zinc/30/19/63/1067301963.db2.gz	IPYGUPMSCYWRHJ-UHFFFAOYSA-N	-1	2	450.611	4.550	20	0		JJADLM
O=C([N-][C@@H]1CN(C(=O)c2cc(Cl)c3ccccc3c2O)CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC001453687296	1067322897	/nfs/dbraw/zinc/32/28/97/1067322897.db2.gz	ZNZCJKHQSUNSFH-FOIQADDNSA-N	-1	2	476.882	4.876	20	0		JJADLM
O=C(N[C@@H]1CN(C(=O)c2cc(Cl)c3ccccc3c2[O-])CC[C@@H]1c1ccccc1)C(F)(F)F	ZINC001453687296	1067322909	/nfs/dbraw/zinc/32/29/09/1067322909.db2.gz	ZNZCJKHQSUNSFH-FOIQADDNSA-N	-1	2	476.882	4.876	20	0		JJADLM
O=C(c1cc2ccccc2cc1O)N(CCn1cc[nH+]c1)Cc1ccccc1Br	ZINC001449377380	1067005390	/nfs/dbraw/zinc/00/53/90/1067005390.db2.gz	VZIKIOJDQAQTNP-UHFFFAOYSA-N	-1	2	450.336	4.847	20	0		JJADLM
O=C(Cc1ccc([N-]S(=O)(=O)c2cccs2)cc1)Nc1cc(Cl)cc(Cl)c1O	ZINC001446234324	1066676529	/nfs/dbraw/zinc/67/65/29/1066676529.db2.gz	VDPRCJVFBNHSCD-UHFFFAOYSA-N	-1	2	457.360	4.743	20	0		JJADLM