1288442

Source:http://linkedlifedata.com/resource/chembl/compound/1288442

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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/C11H8ClFN4/c12-10-11(15-6-5-14-10)17-16-7-8-1-3-9(13)4-2-8/h1-7H,(H,15,17)/b16-7+
chemicalCompound:standardIn...	FRCBCJBNYANDPA-FRKPEAEDSA-N
chemicalCompound:canonicalS...	Fc1ccc(\C=N\Nc2nccnc2Cl)cc1
chemicalCompound:molecularF...	C11H8ClFN4
chemicalCompound:moleculeId	1288442
chemicalCompound:mwFreebase	250.659
chemicalCompound:alogp	2.765
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	50.17
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.811
chemicalCompound:acdLogP	4.224
chemicalCompound:acdLogD	4.222
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	250.659
chemicalCompound:acdMostBpk...	1.645
chemicalCompound:chemblId	CHEMBL1967151
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1388442
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:3804411, activity:3834287, activity:3904970, activity:4057965, activity:4280943, activity:4533979, activity:4536851, activity:4586856, activity:4736030, activity:4823636, activity:4982673, activity:5658338, activity:5869673, activity:6592638, activity:7060063, activity:7169323, activity:7276112, activity:7380900, activity:10419095