377977

Source:http://linkedlifedata.com/resource/chembl/compound/377977

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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/C15H26O2/c1-9-5-6-11(15(3,4)17)7-13-10(2)14(16)8-12(9)13/h8-11,13-14,16-17H,5-7H2,1-4H3/t9-,10+,11+,13-,14-/m0/s1
chemicalCompound:standardIn...	HOIPKOPJTJSELQ-AXMVNOCNSA-N
chemicalCompound:canonicalS...	C[C@H]1CC[C@H](C[C@H]2[C@@H](C)[C@@H](O)C=C12)C(C)(C)O
chemicalCompound:molecularF...	C15 H26 O2
chemicalCompound:moleculeId	377977
chemicalCompound:mwFreebase	238.366
chemicalCompound:alogp	2.676
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	40.46
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.009
chemicalCompound:acdLogD	3.009
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	238.366
chemicalCompound:chemblId	CHEMBL390597
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:477977
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:1863848, activity:1863852