164263

Source:http://linkedlifedata.com/resource/chembl/compound/164263

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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/C16H10ClF3N2O/c17-12-5-6-15(23)13(7-12)22-9-21-8-14(22)10-1-3-11(4-2-10)16(18,19)20/h1-9,23H
chemicalCompound:standardIn...	IQMKPOSFUJNDSH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Oc1ccc(Cl)cc1n2cncc2c3ccc(cc3)C(F)(F)F
chemicalCompound:molecularF...	C16 H10 Cl F3 N2 O
chemicalCompound:moleculeId	164263
chemicalCompound:mwFreebase	338.712
chemicalCompound:alogp	4.674
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	38.04
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	8.516
chemicalCompound:acdLogP	4.066
chemicalCompound:acdLogD	4.027
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	338.712
chemicalCompound:acdMostBpk...	3.677
chemicalCompound:chemblId	CHEMBL318498
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:264263
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:359086