808610

Source:http://linkedlifedata.com/resource/chembl/compound/808610

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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/C24H30N2O/c1-17-6-10-19(11-7-17)16-26-22-4-3-5-23(26)15-21(14-22)25-24(27)20-12-8-18(2)9-13-20/h6-13,21-23H,3-5,14-16H2,1-2H3,(H,25,27)
chemicalCompound:standardIn...	QJBJGFACSBPWFU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cc1ccc(CN2C3CCCC2CC(C3)NC(=O)c4ccc(C)cc4)cc1
chemicalCompound:molecularF...	C24H30N2O
chemicalCompound:moleculeId	808610
chemicalCompound:mwFreebase	362.508
chemicalCompound:alogp	4.679
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	32.34
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	5.041
chemicalCompound:acdLogD	2.582
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	362.508
chemicalCompound:acdMostBpk...	9.93
chemicalCompound:chemblId	CHEMBL1384726
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:908610
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:4300061, activity:5013401, activity:5041138, activity:5330023, activity:5409672, activity:5530662, activity:5537576, activity:5564940, activity:5572192, activity:5855488, activity:5860114, activity:5881611, activity:5977658, activity:7116702, activity:7326280, activity:7477936