smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCc1c([O-])c2cccc3c4ccccc4n(c32)c1=O	ZINC000095670868	563977622	/nfs/dbraw/zinc/97/76/22/563977622.db2.gz	JZFKROGLJGCBEJ-UHFFFAOYSA-N	-1	1	333.431	5.262	10	30		EKEEMM
CCCCCCCCCCCCC/C(=N/[O-])c1cc(O)ccc1O	ZINC000100166808	219093229	/nfs/dbraw/zinc/09/32/29/219093229.db2.gz	XECDFMWMUFTYPP-VZCXRCSSSA-N	-1	1	335.488	5.977	10	30		EKEEMM
CCCCCCCCCCCCC/C(=N/[O-])c1cc(OC)ccc1O	ZINC000100166813	519985540	/nfs/dbraw/zinc/98/55/40/519985540.db2.gz	MFCCSBSLBJTUHE-XDOYNYLZSA-N	-1	1	349.515	6.280	10	30		EKEEMM
C=C(C)[C@H]1CCC(C)=C[C@H]1C1=C([O-])C(=O)C(CCCCC)=CC1=O	ZINC000100292045	219096256	/nfs/dbraw/zinc/09/62/56/219096256.db2.gz	WDXXEUARVHTWQF-IAGOWNOFSA-N	-1	1	328.452	5.006	10	30		EKEEMM
C=C(C)[C@@H]1CCC(C)=C[C@@H]1C1=C([O-])C(=O)C(CCCCC)=CC1=O	ZINC000103542241	219313535	/nfs/dbraw/zinc/31/35/35/219313535.db2.gz	WDXXEUARVHTWQF-IRXDYDNUSA-N	-1	1	328.452	5.006	10	30	in-vitro	EKEEMM
CCCCCCCCCCCCCCCCC(C)(C(=O)[O-])C(=O)O	ZINC000141771548	564130143	/nfs/dbraw/zinc/13/01/43/564130143.db2.gz	QCLVXKHDNXWWHC-UHFFFAOYSA-N	-1	1	342.520	6.033	10	30		EKEEMM