smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
[O-]c1ccc(Cl)cc1/N=C/c1cc(Br)cc(Br)c1[O-]	ZINC000002756216	557380058	/nfs/dbraw/zinc/38/00/58/557380058.db2.gz	ATQAUMKUZJFCMA-UBKPWBPPSA-N	-2	1	405.473	5.027	40	30		HKEBML
Cc1cc(Cl)c([O-])c(/C=N/c2cc(Br)c([O-])c(Br)c2)c1	ZINC000038182150	568486748	/nfs/dbraw/zinc/48/67/48/568486748.db2.gz	XKUGGVCERJQDLD-NGYBGAFCSA-N	-2	1	419.500	5.335	40	30		HKEBML
C/C(=N\c1cc(Cl)ccc1[O-])c1c([O-])c2ccccc2n(-c2ccccc2)c1=O	ZINC000100370449	559134575	/nfs/dbraw/zinc/13/45/75/559134575.db2.gz	MWDOODWUCZOWEJ-AFUMVMLFSA-N	-2	1	404.853	5.196	40	30		HKEBML
Cc1ccc(S(=O)(=O)Nc2ccccc2/N=C/c2c(O)ccc3ccccc32)cc1	ZINC000104104011	559158049	/nfs/dbraw/zinc/15/80/49/559158049.db2.gz	GHOIBIHUGLCMII-PCLIKHOPSA-N	-2	1	416.502	5.405	40	30		HKEBML
COc1cc(/C=N\c2ccc(Cl)cc2[O-])ccc1OCc1cccc(C(=O)[O-])c1	ZINC000408821278	560645484	/nfs/dbraw/zinc/64/54/84/560645484.db2.gz	FNVRZRLNGPZEIG-MSXFZWOLSA-N	-2	1	411.841	5.082	40	30		HKEBML
Cc1cc(/C=N\c2ccc(Cl)cc2[O-])c(C)n1-c1ccc(C(=O)[O-])c(Cl)c1	ZINC000408855531	558691599	/nfs/dbraw/zinc/69/15/99/558691599.db2.gz	NULHIHYEGMZJSM-RMORIDSASA-N	-2	1	403.265	5.555	40	30		HKEBML
Cc1cc(/C=N\c2ccc(Cl)cc2[O-])c(C)n1-c1ccc(Cl)c(C(=O)[O-])c1	ZINC000408935448	560655910	/nfs/dbraw/zinc/65/59/10/560655910.db2.gz	DWAPEQSTZZRZMW-RMORIDSASA-N	-2	1	403.265	5.555	40	30		HKEBML
COc1cc(/C=N\c2ccc(Cl)cc2[O-])ccc1OCc1ccc(C(=O)[O-])cc1	ZINC000408968436	560659505	/nfs/dbraw/zinc/65/95/05/560659505.db2.gz	YVACPRFTESOHIB-MSXFZWOLSA-N	-2	1	411.841	5.082	40	30		HKEBML
COc1cccc(/C=N\c2ccc(Cl)cc2[O-])c1OCc1ccc(C(=O)[O-])cc1	ZINC000409186931	559013572	/nfs/dbraw/zinc/01/35/72/559013572.db2.gz	JTPVUAHFDOJBCX-MSXFZWOLSA-N	-2	1	411.841	5.082	40	30		HKEBML