137008

Source:http://linkedlifedata.com/resource/chembl/compound/137008

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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/C15H19ClN4O/c1-15(2,3)12-9-13(20(4)19-12)18-14(21)17-11-7-5-10(16)6-8-11/h5-9H,1-4H3,(H2,17,18,21)
chemicalCompound:standardIn...	FWIJKWMXNHRSRO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cn1nc(cc1NC(=O)Nc2ccc(Cl)cc2)C(C)(C)C
chemicalCompound:molecularF...	C15H19ClN4O
chemicalCompound:moleculeId	137008
chemicalCompound:mwFreebase	306.791
chemicalCompound:alogp	3.79
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	58.95
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.599
chemicalCompound:acdLogP	2.846
chemicalCompound:acdLogD	2.846
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	306.791
chemicalCompound:acdMostBpk...	3.171
chemicalCompound:chemblId	CHEMBL87277
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:237008
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:399191, activity:938486, activity:938487, activity:1100382, activity:1100383, activity:1100384, activity:1100385, activity:1123633, activity:1123634, activity:1123635, activity:2983795, activity:2983824, activity:3447180, activity:3948070, activity:4510788, activity:5519676, activity:6511292, activity:7489523