188108

Source:http://linkedlifedata.com/resource/chembl/compound/188108

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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/C7H4Cl2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11)
chemicalCompound:standardIn...	MRUDNSFOFOQZDA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(=O)c1c(Cl)cccc1Cl
chemicalCompound:molecularF...	C7 H4 Cl2 O2
chemicalCompound:moleculeId	188108
chemicalCompound:mwFreebase	191.011
chemicalCompound:alogp	2.788
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	37.29
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	1.695
chemicalCompound:acdLogP	2.171
chemicalCompound:acdLogD	-0.978
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	191.011
chemicalCompound:chemblId	CHEMBL114828
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:288108
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:48623
chemicalCompound:activity	activity:263347, activity:263348, activity:5831524, activity:6710640, activity:6750456, activity:6781101