smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc(-c2c(C(=O)[O-])n[nH]c2-c2cc(Cl)c([O-])cc2O)cc1	ZINC000004617889	204150420	/nfs/dbraw/zinc/15/04/20/204150420.db2.gz	VIBPEGKTQCWOSK-UHFFFAOYSA-N	-2	1	360.753	3.515	1	0		FHAFML
Cc1cc(-c2ccc(C(=O)[O-])c(O)c2)oc1C=C1SC(=S)[N-]C1=O	ZINC000040428960	205070380	/nfs/dbraw/zinc/07/03/80/205070380.db2.gz	KYEWMUNQRWULNV-MLPAPPSSSA-N	-2	1	361.400	3.988	1	0		FHAFML
CO[P@](=O)([O-])/C=C/[C@H]([N-]C(=O)C(Cl)(Cl)Cl)c1ccccc1	ZINC000006009854	204233503	/nfs/dbraw/zinc/23/35/03/204233503.db2.gz	PMHATEDYHTVLRG-JARNTUPDSA-N	-2	1	372.572	3.560	1	0		FHAFML
CC1=CCCc2ccc([N-]S(=O)(=O)c3ccc(F)cc3)c(C(=O)[O-])c21	ZINC000006733323	204265000	/nfs/dbraw/zinc/26/50/00/204265000.db2.gz	OCRFJQHVDVDJIO-UHFFFAOYSA-N	-2	1	361.394	3.674	1	0		FHAFML
COc1cc(-c2cc3cc(/C=C/C(=O)[O-])cc([O-])c3o2)ccc1N(C)C	ZINC000096934956	209162508	/nfs/dbraw/zinc/16/25/08/209162508.db2.gz	GGUDELIGBWVBQV-QPJJXVBHSA-N	-2	1	353.374	3.978	1	0		FHAFML
CN1CCc2cc(Cl)c(O)cc2[C@H]2c3cccc(C(=O)[O-])c3CC[C@@H]21	ZINC000045364659	208330757	/nfs/dbraw/zinc/33/07/57/208330757.db2.gz	FYNBSODPHHUGIL-PKOBYXMFSA-N	-2	1	357.837	3.678	1	0		FHAFML
COc1ccc(-c2cc3cc(/C=C/C(=O)[O-])cc([O-])c3o2)cc1N(C)C	ZINC000096934924	209162611	/nfs/dbraw/zinc/16/26/11/209162611.db2.gz	FKDHFVBIOUVOJL-QPJJXVBHSA-N	-2	1	353.374	3.978	1	0		FHAFML
CCc1cc(Cc2c(C)cc(OCP(=O)([O-])[O-])cc2C)ccc1O	ZINC000045484881	208333843	/nfs/dbraw/zinc/33/38/43/208333843.db2.gz	WSVRWYNJPONDQC-UHFFFAOYSA-N	-2	1	350.351	3.676	1	0		FHAFML
CC(C)=CCC/C(C)=C/CCC[C@H]([P@](=O)([O-])CO)[P@](=O)([O-])O	ZINC000013742084	211055652	/nfs/dbraw/zinc/05/56/52/211055652.db2.gz	MOUIHKXMHOTURX-MAUPQMMJSA-N	-2	1	354.320	3.573	1	0		FHAFML
CC(C)=CCC/C(C)=C/CCC[C@@H]([P@](=O)([O-])CO)[P@](=O)([O-])O	ZINC000013742085	220092668	/nfs/dbraw/zinc/09/26/68/220092668.db2.gz	MOUIHKXMHOTURX-CZAWJFPGSA-N	-2	1	354.320	3.573	1	0		FHAFML