55292

Source:http://linkedlifedata.com/resource/chembl/compound/55292

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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/C22H26N4O/c1-14-13-24-22(23-10-5-11-26(2)3)20-19-17-8-7-16(27-4)12-15(17)6-9-18(19)25-21(14)20/h6-9,12-13,25H,5,10-11H2,1-4H3,(H,23,24)
chemicalCompound:standardIn...	YDJMNPZCCPMRPI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccc2c(ccc3[nH]c4c(C)cnc(NCCCN(C)C)c4c23)c1
chemicalCompound:molecularF...	C22 H26 N4 O
chemicalCompound:moleculeId	55292
chemicalCompound:mwFreebase	362.468
chemicalCompound:alogp	3.627
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	53.18
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	4.638
chemicalCompound:acdLogD	1.002
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	362.468
chemicalCompound:acdMostBpk...	9.773
chemicalCompound:chemblId	CHEMBL35935
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:155292
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:1284221, activity:1284222, activity:1284223, activity:1284224, activity:1284225, activity:1284226, activity:1284227, activity:1284228, activity:1284229