4361

Source:http://linkedlifedata.com/resource/chembl/compound/4361

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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:4361_(Z)-OCTADEC-9-ENOIC ACID_TRADE_NAME, synonym:4361_OLEIC ACID_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-
chemicalCompound:standardIn...	ZQPPMHVWECSIRJ-KTKRTIGZSA-N
chemicalCompound:canonicalS...	CCCCCCCC\C=C/CCCCCCCC(=O)O
chemicalCompound:molecularF...	C18H34O2
chemicalCompound:moleculeId	4361
chemicalCompound:mwFreebase	282.461
chemicalCompound:alogp	6.86
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	15
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.777
chemicalCompound:acdLogP	7.421
chemicalCompound:acdLogD	4.828
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	282.461
chemicalCompound:chemblId	CHEMBL8659
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:104361
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	OLEIC ACID
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:16196
chemicalCompound:activity	activity:411576, activity:799412, activity:1104679, activity:1104680, activity:1111690, activity:1111691, activity:1404404, activity:1442687, activity:1442688, activity:1442689, activity:2032321, activity:2032333, activity:2032334, activity:2148527, activity:2148529, activity:2148533, activity:2148534, activity:2148535, activity:2148536, activity:2148540, activity:2150476, activity:2150496, activity:2150497, activity:2193329, activity:2193536, activity:2193543, activity:2324045, activity:2324051, activity:2324056, activity:2324072, activity:2324085, activity:2324090, activity:2325118, activity:2325135, activity:2381448, activity:2424915, activity:2430363, activity:2445240, activity:2445246, activity:2445247, activity:2445248, activity:2539852, activity:2539856, activity:2539863, activity:2677227, activity:2677234, activity:2677244, activity:3066538, activity:3066539, activity:3066551, activity:3308722, activity:3308740, activity:3473421, activity:3598733, activity:3598748, activity:3714834, activity:3765244, activity:3795503, activity:4053006, activity:4057302, activity:4108043, activity:4832319, activity:4837719