1153422

Source:http://linkedlifedata.com/resource/chembl/compound/1153422

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C12H17N/c13-12-7-3-1-5-9(7)10-6(11(5)12)2-4-8(10)12/h5-11H,1-4,13H2
chemicalCompound:standardIn...	ABYQHYZEUZMTKM-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NC12C3CCC4C3C5C(CCC15)C24
chemicalCompound:molecularF...	C12H17N
chemicalCompound:moleculeId	1153422
chemicalCompound:mwFreebase	175.27
chemicalCompound:alogp	1.049
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	26.02
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.584
chemicalCompound:acdLogD	-0.445
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	175.27
chemicalCompound:acdMostBpk...	11.248
chemicalCompound:chemblId	CHEMBL1789771
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1253422
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No