203542

Source:http://linkedlifedata.com/resource/chembl/compound/203542

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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/C12H10O/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9,13H
chemicalCompound:standardIn...	UBXYXCRCOKCZIT-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1cccc(c1)c2ccccc2
chemicalCompound:molecularF...	C12H10O
chemicalCompound:moleculeId	203542
chemicalCompound:mwFreebase	170.207
chemicalCompound:alogp	3.106
chemicalCompound:hba	1
chemicalCompound:hbd	1
chemicalCompound:psa	20.23
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.739
chemicalCompound:acdLogP	3.474
chemicalCompound:acdLogD	3.472
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	170.207
chemicalCompound:chemblId	CHEMBL122570
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:303542
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:34338
chemicalCompound:activity	activity:780757, activity:3291852, activity:3291873, activity:7564845, activity:7564846, activity:7564847, activity:7564848