545974

Source:http://linkedlifedata.com/resource/chembl/compound/545974

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:52523
chemicalCompound:synonym	synonym:545974_Memantine Hydrochloride_USAN, synonym:545974_Memantine hydrochloride_FDA_ALTERNATIVE_NAME, synonym:545974_Namenda_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C12H21N.ClH/c1-10-3-9-4-11(2,6-10)8-12(13,5-9)7-10;/h9H,3-8,13H2,1-2H3;1H
chemicalCompound:standardIn...	LDDHMLJTFXJGPI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CC12CC3CC(C)(C1)CC(N)(C3)C2
chemicalCompound:molecularF...	C12H22ClN
chemicalCompound:moleculeId	545974
chemicalCompound:mwFreebase	179.302
chemicalCompound:alogp	1.907
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	26.02
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.004
chemicalCompound:acdLogD	0.082
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	215.763
chemicalCompound:acdMostBpk...	10.794
chemicalCompound:chemblId	CHEMBL1699
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:645974
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	MEMANTINE HYDROCHLORIDE
chemicalCompound:firstAppro...	2003
chemicalCompound:activity	activity:208087, activity:208088, activity:3473116, activity:3490234, activity:3490235, activity:3490236, activity:3490237, activity:3636025, activity:3663772, activity:3693428, activity:3697207, activity:3974168, activity:4279467, activity:4358726, activity:4536236, activity:4670100, activity:4913375, activity:4970559, activity:5698004, activity:5866929, activity:6790762, activity:6795750, activity:6809791, activity:7101479, activity:7458582, activity:7530327, activity:7538345