160233

Source:http://linkedlifedata.com/resource/chembl/compound/160233

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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/C24H27N5O2/c1-17-25-22-18-7-3-4-8-19(18)26-23(22)24(30)29(17)16-13-27-11-14-28(15-12-27)20-9-5-6-10-21(20)31-2/h3-10,30H,11-16H2,1-2H3
chemicalCompound:standardIn...	PTZPHMWEBRURCP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccccc1N2CCN(CCn3c(C)nc4c5ccccc5nc4c3O)CC2
chemicalCompound:molecularF...	C24 H27 N5 O2
chemicalCompound:moleculeId	160233
chemicalCompound:mwFreebase	417.503
chemicalCompound:alogp	3.769
chemicalCompound:hba	6
chemicalCompound:hbd	1
chemicalCompound:psa	66.65
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	6.64
chemicalCompound:acdLogP	4.249
chemicalCompound:acdLogD	3.53
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	417.503
chemicalCompound:acdMostBpk...	7.135
chemicalCompound:chemblId	CHEMBL99142
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:260233
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:1162058, activity:1162059, activity:1162060