652301

Source:http://linkedlifedata.com/resource/chembl/compound/652301

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
chemicalCompound:standardIn...	InChI=1S/C22H24N/c1-23(2)15-13-19(14-16-23)22-20-9-5-3-7-17(20)11-12-18-8-4-6-10-21(18)22/h3-12H,13-16H2,1-2H3/q+1
chemicalCompound:standardIn...	YQTBVVVHPJFYDG-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C[N+]1(C)CCC(=C2c3ccccc3C=Cc4ccccc24)CC1
chemicalCompound:molecularF...	C22H24N
chemicalCompound:moleculeId	652301
chemicalCompound:mwFreebase	302.433
chemicalCompound:alogp	3.007
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.141
chemicalCompound:acdLogD	3.141
chemicalCompound:fullMwt	302.433
chemicalCompound:chemblId	CHEMBL1178351
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:752301
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No