smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)(C)OC(=O)c1nn(-c2ccc(Br)cc2)c(=O)[nH]1	ZINC000036533605	213099039	/nfs/dbraw/zinc/09/90/39/213099039.db2.gz	WOWOFVOEDBANFI-UHFFFAOYSA-N	0	2	340.177	2.691	30	0		EFACLN
Cc1ccc(-n2nc(C(=O)Nc3ccccc3Cl)[nH]c2=O)cc1	ZINC000015444130	471905317	/nfs/dbraw/zinc/90/53/17/471905317.db2.gz	DFHFRKCXYUANMP-UHFFFAOYSA-N	0	2	328.759	2.775	30	0		EFACLN
O=C(c1nn(-c2cccc(Br)c2)c(=O)[nH]1)c1ccccc1	ZINC000015444183	471905522	/nfs/dbraw/zinc/90/55/22/471905522.db2.gz	BHQHNTCNJNBBRZ-UHFFFAOYSA-N	0	2	344.168	2.554	30	0		EFACLN
O=C(OCc1ccccc1)c1nn(-c2ccc(Cl)cc2)c(=O)[nH]1	ZINC000015444285	471906045	/nfs/dbraw/zinc/90/60/45/471906045.db2.gz	GGUMCTPMXGCNPC-UHFFFAOYSA-N	0	2	329.743	2.571	30	0		EFACLN
O=C(OCc1ccccc1)c1nn(-c2cccc(Cl)c2)c(=O)[nH]1	ZINC000015444289	471905841	/nfs/dbraw/zinc/90/58/41/471905841.db2.gz	IENYRCOZZKSLNP-UHFFFAOYSA-N	0	2	329.743	2.571	30	0		EFACLN
CCOC(=O)c1nn(-c2c(Cl)cc(Cl)cc2Cl)c(=O)[nH]1	ZINC000015444163	471906025	/nfs/dbraw/zinc/90/60/25/471906025.db2.gz	IICAFYOYSZXMOI-UHFFFAOYSA-N	0	2	336.562	2.698	30	0		EFACLN