921746

Source:http://linkedlifedata.com/resource/chembl/compound/921746

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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/C19H20ClFN4O3/c1-4-25-12(3)15(11(2)23-25)9-22-19(26)17-8-14(28-24-17)10-27-18-6-5-13(21)7-16(18)20/h5-8H,4,9-10H2,1-3H3,(H,22,26)
chemicalCompound:standardIn...	NZGMCNNTJNEOHA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCn1nc(C)c(CNC(=O)c2cc(COc3ccc(F)cc3Cl)on2)c1C
chemicalCompound:molecularF...	C19H20ClFN4O3
chemicalCompound:moleculeId	921746
chemicalCompound:mwFreebase	406.839
chemicalCompound:alogp	3.446
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	82.18
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.126
chemicalCompound:acdLogP	1.713
chemicalCompound:acdLogD	1.713
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	406.839
chemicalCompound:acdMostBpk...	2.637
chemicalCompound:chemblId	CHEMBL1497862
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1021746
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:3832978, activity:4070707, activity:4209173, activity:4701304, activity:4851291, activity:5591161, activity:5725108, activity:5853451, activity:5890785, activity:7020656, activity:7026535, activity:7258235, activity:7411141