113484

Source:http://linkedlifedata.com/resource/chembl/compound/113484

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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/C13H20N/c1-14(2)10-8-13(9-11-14)12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3/q+1
chemicalCompound:standardIn...	JXLRDUKTARNOEI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	C[N+]1(C)CCC(CC1)c2ccccc2
chemicalCompound:molecularF...	C13 H20 N
chemicalCompound:moleculeId	113484
chemicalCompound:mwFreebase	190.305
chemicalCompound:alogp	1.166
chemicalCompound:hba	0
chemicalCompound:hbd	0
chemicalCompound:psa	0
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.943
chemicalCompound:acdLogD	-0.943
chemicalCompound:fullMwt	190.305
chemicalCompound:chemblId	CHEMBL73120
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:213484
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:1012660, activity:1012661