453717

Source:http://linkedlifedata.com/resource/chembl/compound/453717

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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/C11H20Cl2N2O2/c1-2-17-11(16)10-7-9(8-14-10)15(5-3-12)6-4-13/h9-10,14H,2-8H2,1H3/t9?,10-/m0/s1
chemicalCompound:standardIn...	UWJJSBXYRAPJEN-AXDSSHIGSA-N
chemicalCompound:canonicalS...	CCOC(=O)[C@@H]1CC(CN1)N(CCCl)CCCl
chemicalCompound:molecularF...	C11H20Cl2N2O2
chemicalCompound:moleculeId	453717
chemicalCompound:mwFreebase	283.195
chemicalCompound:alogp	1.354
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	41.57
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.758
chemicalCompound:acdLogD	1.384
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	283.195
chemicalCompound:acdMostBpk...	7.556
chemicalCompound:chemblId	CHEMBL506341
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:553717
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	AZIPRIN
chemicalCompound:activity	activity:2588795, activity:2588841