1248534

Source:http://linkedlifedata.com/resource/chembl/compound/1248534

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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/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h4,9-11H,1,5-6H2,2-3H3/t9-,10+/m1/s1
chemicalCompound:standardIn...	BAVONGHXFVOKBV-ZJUUUORDSA-N
chemicalCompound:canonicalS...	CC(=C)[C@@H]1CC=C(C)[C@@H](O)C1
chemicalCompound:molecularF...	C10H16O
chemicalCompound:moleculeId	1248534
chemicalCompound:mwFreebase	152.233
chemicalCompound:alogp	2.4
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	20.23
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.819
chemicalCompound:acdLogD	2.819
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	152.233
chemicalCompound:chemblId	CHEMBL1907992
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1348534
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:7564298, activity:7564299