477584

Source:http://linkedlifedata.com/resource/chembl/compound/477584

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C13H21ClO5/c1-12(2)16-8-6(14)7(15-5)9-11(10(8)18-12)19-13(3,4)17-9/h6-11H,1-5H3/t6-,7-,8+,9+,10+,11+/m0/s1
chemicalCompound:standardIn...	NDMLPFGISIJEOY-HGQQYVGVSA-N
chemicalCompound:canonicalS...	CO[C@H]1[C@H](Cl)[C@H]2OC(C)(C)O[C@H]2[C@@H]3OC(C)(C)O[C@H]13
chemicalCompound:molecularF...	C13H21ClO5
chemicalCompound:moleculeId	477584
chemicalCompound:mwFreebase	292.756
chemicalCompound:alogp	0.018
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	46.15
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdLogP	1.489
chemicalCompound:acdLogD	1.489
chemicalCompound:fullMwt	292.756
chemicalCompound:chemblId	CHEMBL493332
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:577584
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:2282997