smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C/C(=N\c1cc(Cl)ccc1[O-])c1c([O-])c2ccccc2n(C)c1=O	ZINC000101161062	204002160	/nfs/dbraw/zinc/00/21/60/204002160.db2.gz	XJPHYZHBUOINQX-KEBDBYFISA-N	-2	1	342.782	3.744	40	30		EHEBML
COc1cccc(/C=N\c2ccc(Cl)cc2[O-])c1O[C@@H](C)C(=O)[O-]	ZINC000409233902	564011284	/nfs/dbraw/zinc/01/12/84/564011284.db2.gz	UNJGBDVKEVBAEM-OVNPTBDBSA-N	-2	1	349.770	3.657	40	30		EHEBML
CCn1c(=O)c(/C=N/c2cc(Cl)ccc2[O-])c([O-])c2ccccc21	ZINC000103461947	219302734	/nfs/dbraw/zinc/30/27/34/219302734.db2.gz	BWOZKQXOCCCXGL-KEBDBYFISA-N	-2	1	342.782	3.837	40	30		EHEBML
COc1cccc(/C=N\c2ccc(Cl)cc2[O-])c1O[C@H](C)C(=O)[O-]	ZINC000409233899	564011273	/nfs/dbraw/zinc/01/12/73/564011273.db2.gz	UNJGBDVKEVBAEM-DWOMLUCJSA-N	-2	1	349.770	3.657	40	30		EHEBML
O=C([O-])COc1ccc(/C=N\c2ccc(Cl)cc2[O-])cc1Cl	ZINC000408848989	564007596	/nfs/dbraw/zinc/00/75/96/564007596.db2.gz	TYKIHJLAJRSCRP-WSVATBPTSA-N	-2	1	340.162	3.913	40	30		EHEBML