453475

Source:http://linkedlifedata.com/resource/chembl/compound/453475

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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/C9H9ClN2O2/c10-7(8(13)12-9(11)14)6-4-2-1-3-5-6/h1-5,7H,(H3,11,12,13,14)
chemicalCompound:standardIn...	LEJPVKTZROTWBE-UHFFFAOYSA-N
chemicalCompound:canonicalS...	NC(=O)NC(=O)C(Cl)c1ccccc1
chemicalCompound:molecularF...	C9H9ClN2O2
chemicalCompound:moleculeId	453475
chemicalCompound:mwFreebase	212.633
chemicalCompound:alogp	1.199
chemicalCompound:hba	2
chemicalCompound:hbd	2
chemicalCompound:psa	72.19
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.971
chemicalCompound:acdLogP	1.282
chemicalCompound:acdLogD	1.273
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	212.633
chemicalCompound:chemblId	CHEMBL462571
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:553475
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	CHLORPHENACEMIDE
chemicalCompound:activity	activity:2589982, activity:2589987, activity:2589997