178597

Source:http://linkedlifedata.com/resource/chembl/compound/178597

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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/C10H20O2/c1-2-3-4-5-6-7-8-9-10(11)12/h2-9H2,1H3,(H,11,12)
chemicalCompound:standardIn...	GHVNFZFCNZKVNT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCCCCCCCCC(=O)O
chemicalCompound:molecularF...	C10H20O2
chemicalCompound:moleculeId	178597
chemicalCompound:mwFreebase	172.265
chemicalCompound:alogp	3.655
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.787
chemicalCompound:acdLogP	3.754
chemicalCompound:acdLogD	1.17
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	172.265
chemicalCompound:chemblId	CHEMBL107498
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:278597
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	DECANOIC ACID
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:30813
chemicalCompound:activity	activity:88075, activity:794758, activity:794759, activity:794760, activity:794761, activity:794762, activity:3366158, activity:3923820, activity:4619643, activity:6199084, activity:6199089, activity:6750608, activity:7047068, activity:7224269, activity:7564663, activity:7565110, activity:7565111