251252

Source:http://linkedlifedata.com/resource/chembl/compound/251252

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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/C15H17NO/c1-2-3-12-17-15-6-4-13(5-7-15)14-8-10-16-11-9-14/h4-11H,2-3,12H2,1H3
chemicalCompound:standardIn...	CFJNAALMLFXEDF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCOc1ccc(cc1)c2ccncc2
chemicalCompound:molecularF...	C15 H17 N O
chemicalCompound:moleculeId	251252
chemicalCompound:mwFreebase	227.302
chemicalCompound:alogp	3.51
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	22.12
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.004
chemicalCompound:acdLogD	3.984
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	227.302
chemicalCompound:acdMostBpk...	6.062
chemicalCompound:chemblId	CHEMBL151280
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:351252
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:481717, activity:481718, activity:481719, activity:481720, activity:481721, activity:481722