smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
NC(=NOCC[C@@H]([NH3+])C(=O)[O-])N[C@H](CC(=O)[O-])C(=O)[O-]	ZINC000059065046	574415327	/nfs/dbraw/zinc/41/53/27/574415327.db2.gz	SGYMGUGIGTWWLU-RFZPGFLSSA-N	-2	1	292.248	-2.448	1	30	endogenous,in-man	CAEFML
O=S(=O)([O-])Oc1c([O-])oc([C@@H](O)CO)c1O	ZINC000005178938	170074038	/nfs/dbraw/zinc/07/40/38/170074038.db2.gz	SKKZOYBAANIUOV-ZAFYKAAXSA-N	-2	1	256.188	-2.146	1	30		CAEFML
NC(=NC(=O)NC[C@@H](CO)OCP(=O)([O-])[O-])NC=O	ZINC000035259970	172091838	/nfs/dbraw/zinc/09/18/38/172091838.db2.gz	CPFLCVNPSGPNHC-YFKPBYRVSA-N	-2	1	298.192	-1.890	1	30		CAEFML
NC(=NOCC[C@@H]([NH3+])C(=O)[O-])N[C@@H](CC(=O)[O-])C(=O)[O-]	ZINC000014919535	560227449	/nfs/dbraw/zinc/22/74/49/560227449.db2.gz	SGYMGUGIGTWWLU-UHNVWZDZSA-N	-2	1	292.248	-2.448	1	30	endogenous,in-man	CAEFML
NC(N)=NC(=O)NC[C@@H](CO)OCP(=O)([O-])[O-]	ZINC000035259971	172091614	/nfs/dbraw/zinc/09/16/14/172091614.db2.gz	GHHSSMFHIXUDTL-BYPYZUCNSA-N	-2	1	270.182	-2.518	1	30		CAEFML