36315

Source:http://linkedlifedata.com/resource/chembl/compound/36315

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:36315_Celupan_TRADE_NAME, synonym:36315_EN-1639A_RESEARCH_CODE, synonym:36315_Naltrexone_BAN, synonym:36315_Naltrexone_FDA_ALTERNATIVE_NAME, synonym:36315_Naltrexone_INN, synonym:36315_Naltrexone_USAN, synonym:36315_Revia_OTHER, synonym:36315_Trexal_TRADE_NAME, synonym:36315_Trexan_TRADE_NAME, synonym:36315_Vivitrol_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15?,18-,19-,20+/m0/s1
chemicalCompound:standardIn...	DQCKKXVULJGBQN-VCPZZJCDSA-N
chemicalCompound:canonicalS...	Oc1ccc2CC3N(CC4CC4)CC[C@@]56[C@@H](Oc1c25)C(=O)CC[C@@]36O
chemicalCompound:molecularF...	C20H23NO4
chemicalCompound:moleculeId	36315
chemicalCompound:mwFreebase	341.401
chemicalCompound:alogp	1.657
chemicalCompound:hba	5
chemicalCompound:hbd	2
chemicalCompound:psa	70
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.165
chemicalCompound:acdLogP	2.048
chemicalCompound:acdLogD	1.602
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	341.401
chemicalCompound:acdMostBpk...	7.5
chemicalCompound:chemblId	CHEMBL142
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:136315
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	Yes
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	Yes
chemicalCompound:proDrug	No
chemicalCompound:prefName	NALTREXONE
chemicalCompound:firstAppro...	1984
chemicalCompound:activity	activity:68333, activity:68334, activity:68335, activity:68336, activity:68337, activity:68338, activity:68339, activity:68340, activity:79547, activity:79548, activity:79549, activity:79550, activity:79551, activity:79552, activity:79553, activity:79554, activity:79555, activity:105559, activity:105560, activity:105561, activity:105562, activity:105563, activity:105950, activity:105951, activity:105952, activity:105953, activity:105954, activity:105955, activity:105956, activity:105957, activity:105958, activity:105959, activity:105960, activity:108195, activity:108196, activity:108197, activity:108198, activity:108199, activity:108200, activity:131155, activity:131156, activity:131157, activity:131158, activity:131159, activity:143152, activity:143153, activity:143154, activity:143155, activity:143156, activity:143157, activity:143158, activity:143159, activity:143160, activity:143161