146267

Source:http://linkedlifedata.com/resource/chembl/compound/146267

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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/C9H16NO/c1-8-5-6-9(11-8)7-10(2,3)4/h5-6H,7H2,1-4H3/q+1
chemicalCompound:standardIn...	KOWVJDFMEZKDDT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1oc(C[N+](C)(C)C)cc1
chemicalCompound:molecularF...	C9H16NO
chemicalCompound:moleculeId	146267
chemicalCompound:mwFreebase	154.229
chemicalCompound:alogp	-0.124
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	13.14
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-2.607
chemicalCompound:acdLogD	-2.607
chemicalCompound:fullMwt	154.229
chemicalCompound:chemblId	CHEMBL92387
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:246267
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:46127, activity:46128, activity:46129, activity:46130, activity:46131, activity:46132, activity:46133, activity:46134, activity:46135, activity:2446316, activity:2446336, activity:2446356, activity:2446376, activity:2446396, activity:3628811, activity:4411920, activity:5065345, activity:5077025, activity:5517878, activity:5520487, activity:5994691, activity:6024450, activity:6045466, activity:6048606, activity:6055976, activity:7039100