68021

Source:http://linkedlifedata.com/resource/chembl/compound/68021

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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/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2
chemicalCompound:standardIn...	XCIXKGXIYUWCLL-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC1CCCC1
chemicalCompound:molecularF...	C5H10O
chemicalCompound:moleculeId	68021
chemicalCompound:mwFreebase	86.1323
chemicalCompound:alogp	1.044
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	20.23
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	0.755
chemicalCompound:acdLogD	0.755
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	86.1323
chemicalCompound:chemblId	CHEMBL288998
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:168021
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	CYCLOPENTANOL
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16133
chemicalCompound:activity	activity:1015475, activity:2385269, activity:3902784, activity:3911420, activity:4226265, activity:4706960, activity:4865036, activity:6489069, activity:7138933