smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#C[C@@H]1c2cc(C(F)(F)F)ccc2C(=O)N1[C@H](CC(=O)[O-])C(=O)[O-]	ZINC000071681025	203102133	/nfs/dbraw/zinc/10/21/33/203102133.db2.gz	DHZKMSYPZBMIJE-NXEZZACHSA-N	-2	1	342.229	1.654	10	30		EDEEML
C=CC[C@H]([N-]S(=O)(=O)c1sccc1Br)C(=O)[O-]	ZINC000161270242	540032174	/nfs/dbraw/zinc/03/21/74/540032174.db2.gz	WUPYUWOPXLZZHV-ZETCQYMHSA-N	-2	1	340.220	1.818	10	30		EDEEML
C=C(Br)C[N-]S(=O)(=O)c1scnc1C(=O)[O-]	ZINC000168200156	526429512	/nfs/dbraw/zinc/42/95/12/526429512.db2.gz	UBRJPUALFVNLQN-UHFFFAOYSA-N	-2	1	327.181	1.028	10	30		EDEEML
N#Cc1ccccc1S(=O)(=O)Nc1cc(C(=O)[O-])cc(C(=O)[O-])c1	ZINC000013262924	441155720	/nfs/dbraw/zinc/15/57/20/441155720.db2.gz	MIGZSWHFLTUPSH-UHFFFAOYSA-N	-2	1	346.320	1.755	10	30		EDEEML
O=C([O-])C1=CSC2=NC(=NC(=O)OCc3ccccc3)[N-]C(=O)[C@@H]12	ZINC000584880389	448663240	/nfs/dbraw/zinc/66/32/40/448663240.db2.gz	WROUMGBPZZQNLL-SNVBAGLBSA-N	-2	1	345.336	1.539	10	30		EDEEML
O=C([O-])Cc1sc(NN=Cc2ccccc2OC(F)F)nc1[O-]	ZINC000027299189	527632282	/nfs/dbraw/zinc/63/22/82/527632282.db2.gz	CZAVFLPBYGQHNC-SWEBQMAJSA-N	-2	1	343.311	1.684	10	30		EDEEML