smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1ccc(/N=C/c2cc(Cc3ccccc3)cc(Br)c2[O-])cc1O	ZINC000016480923	556611708	/nfs/dbraw/zinc/61/17/08/556611708.db2.gz	LYHQAGWDVGOKCZ-FSJBWODESA-N	-2	1	426.266	4.900	40	30		IJEBML
O=C1c2ccccc2S/C1=C/c1cc(Br)c([O-])c(Br)c1[O-]	ZINC000096580894	557838211	/nfs/dbraw/zinc/83/82/11/557838211.db2.gz	VHHHVJAFGMJUDW-IZZDOVSWSA-N	-2	1	428.101	4.952	40	30		IJEBML
C=CCc1cc(C=C2C(=O)[N-]C(=O)N(c3ccc(F)cc3)C2=O)cc(Br)c1[O-]	ZINC000059135554	557815372	/nfs/dbraw/zinc/81/53/72/557815372.db2.gz	JZEFZYFCHNYYIL-OQLLNIDSSA-N	-2	1	445.244	4.529	40	30		IJEBML
Cc1[n-]n(-c2ccc(C)c(C)c2)c(=O)c1N=Nc1cccc(-c2cccc(C(=O)[O-])c2)c1[O-]	ZINC000299848778	569284277	/nfs/dbraw/zinc/28/42/77/569284277.db2.gz	XDXWLKQMMKQXPV-UHFFFAOYSA-N	-3	1	442.475	4.565	40	30		IJEBML