108

Source:http://linkedlifedata.com/resource/chembl/compound/108

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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/C13H8O4/c14-10-6-5-8-7-3-1-2-4-9(7)13(16)17-12(8)11(10)15/h1-6,14-15H
chemicalCompound:standardIn...	XVLDXKNPWFEZHU-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1ccc2c(OC(=O)c3ccccc23)c1O
chemicalCompound:molecularF...	C13 H8 O4
chemicalCompound:moleculeId	108
chemicalCompound:mwFreebase	228.2
chemicalCompound:alogp	2.466
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	66.76
chemicalCompound:rtb	0
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.066
chemicalCompound:acdLogP	2.252
chemicalCompound:acdLogD	2.155
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	228.2
chemicalCompound:chemblId	CHEMBL6364
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:100108
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:85293