smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1C=C([O-])C(O)C(=CCc2cccc(CCc3ccccc3)c2)C1=O	ZINC000014951902	581098182	/nfs/dbraw/zinc/09/81/82/581098182.db2.gz	VWRHOOMYZHXJGF-UHFFFAOYSA-N	-1	2	348.398	3.810	1	30		EHEFLM
O=C1C=C([O-])C(=O)C(=CCc2cccc(CCc3ccccc3)c2)C1O	ZINC000014951902	581098183	/nfs/dbraw/zinc/09/81/83/581098183.db2.gz	VWRHOOMYZHXJGF-UHFFFAOYSA-N	-1	2	348.398	3.810	1	30		EHEFLM
O=C1C(=O)C(c2ccccc2)C(=O)C([O-])=C1c1coc2ccccc21	ZINC000037866064	202372004	/nfs/dbraw/zinc/37/20/04/202372004.db2.gz	HYTFYBJDTNAOJU-UHFFFAOYSA-N	-1	2	332.311	3.823	1	30		EHEFLM
N#[N+][N-][C@H]1CC[C@@H](N=[N+]=[N-])c2ccc(C(O)=CC(=O)C(=O)[O-])cc21	ZINC000100990360	204000183	/nfs/dbraw/zinc/00/01/83/204000183.db2.gz	CRQXKCSCNKMHHH-HPTVMLIKSA-N	-1	2	328.288	3.736	1	30		EHEFLM
N#[N+][N-][C@H]1CC[C@H](N=[N+]=[N-])c2cc(C(O)=CC(=O)C(=O)[O-])ccc21	ZINC000100990353	204000423	/nfs/dbraw/zinc/00/04/23/204000423.db2.gz	CRQXKCSCNKMHHH-NYDONADRSA-N	-1	2	328.288	3.736	1	30		EHEFLM
N#[N+][N-][C@@H]1CC[C@@H](N=[N+]=[N-])c2cc(C(O)=CC(=O)C(=O)[O-])ccc21	ZINC000100990356	219112935	/nfs/dbraw/zinc/11/29/35/219112935.db2.gz	CRQXKCSCNKMHHH-ZOINEBSPSA-N	-1	2	328.288	3.736	1	30		EHEFLM
N#[N+][N-][C@H]1CC[C@@H](N=[N+]=[N-])c2cc(C(O)=CC(=O)C(=O)[O-])ccc21	ZINC000100990350	219112944	/nfs/dbraw/zinc/11/29/44/219112944.db2.gz	CRQXKCSCNKMHHH-GNAUDSRASA-N	-1	2	328.288	3.736	1	30		EHEFLM