124814

Source:http://linkedlifedata.com/resource/chembl/compound/124814

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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/C17H25N3/c1-3-10-19(11-4-2)14-8-9-16-15(13-14)17-7-5-6-12-20(17)18-16/h5-7,12,14H,3-4,8-11,13H2,1-2H3/t14-/m0/s1
chemicalCompound:standardIn...	PWWITWFCENNJEP-AWEZNQCLSA-N
chemicalCompound:canonicalS...	CCCN(CCC)[C@H]1CCc2nn3ccccc3c2C1
chemicalCompound:molecularF...	C17 H25 N3
chemicalCompound:moleculeId	124814
chemicalCompound:mwFreebase	271.401
chemicalCompound:alogp	3.764
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	20.54
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.424
chemicalCompound:acdLogD	1.683
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	271.401
chemicalCompound:acdMostBpk...	9.162
chemicalCompound:chemblId	CHEMBL310867
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:224814
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:774773, activity:774774, activity:774775, activity:774776, activity:774777, activity:774778, activity:774779, activity:774780, activity:774781, activity:774782, activity:774783