smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C([O-])c1c(Nc2ccc3c(c2)CCC3)cccc1C(=O)O	ZINC000117652473	345985002	/nfs/dbraw/zinc/98/50/02/345985002.db2.gz	LAYSYMKBKPEELW-UHFFFAOYSA-N	-1	2	297.310	3.315	10	0		CGAELM
Oc1cccc(C[N@@H+]2CCO[C@H]3CCCC[C@@H]32)c1Cl	ZINC000295330411	372739410	/nfs/dbraw/zinc/73/94/10/372739410.db2.gz	LWPPEPRXBKAFBY-JSGCOSHPSA-N	-1	2	281.783	3.189	10	0		CGAELM
C#CCC(CCCCCCCCC)(C(=O)[O-])C(=O)O	ZINC000139154536	346099121	/nfs/dbraw/zinc/09/91/21/346099121.db2.gz	ZPEDGUPVNWIIEQ-UHFFFAOYSA-N	-1	2	268.353	3.306	10	0		CGAELM
Nc1cc(C(=O)[O-])cc(S)c1Sc1ccccc1	ZINC000584597860	346688502	/nfs/dbraw/zinc/68/85/02/346688502.db2.gz	QAPQMVXIBXUVRX-UHFFFAOYSA-N	-1	2	277.370	3.407	10	0		CGAELM
Oc1cccc(C[N@@H+]2CCO[C@@H]3CCCC[C@@H]32)c1Cl	ZINC000295330398	372739090	/nfs/dbraw/zinc/73/90/90/372739090.db2.gz	LWPPEPRXBKAFBY-GXTWGEPZSA-N	-1	2	281.783	3.189	10	0		CGAELM
Nc1cc(C(=O)[O-])cc(S)c1Oc1ccccc1	ZINC000144358708	346117855	/nfs/dbraw/zinc/11/78/55/346117855.db2.gz	WZZOFEQPOFKTFE-UHFFFAOYSA-N	-1	2	261.302	3.048	10	0		CGAELM
Oc1cccc(C[N@@H+]2CCO[C@H]3CCCC[C@H]32)c1Cl	ZINC000295330425	372738851	/nfs/dbraw/zinc/73/88/51/372738851.db2.gz	LWPPEPRXBKAFBY-OCCSQVGLSA-N	-1	2	281.783	3.189	10	0		CGAELM
Oc1cccc(C[N@@H+]2CCO[C@@H]3CCCC[C@H]32)c1Cl	ZINC000295330438	372739785	/nfs/dbraw/zinc/73/97/85/372739785.db2.gz	LWPPEPRXBKAFBY-TZMCWYRMSA-N	-1	2	281.783	3.189	10	0		CGAELM