182219

Source:http://linkedlifedata.com/resource/chembl/compound/182219

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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/C15H19Cl2NO2/c1-3-20-14(19)15(6-8-18(2)9-7-15)11-4-5-12(16)13(17)10-11/h4-5,10H,3,6-9H2,1-2H3
chemicalCompound:standardIn...	CVNBITYLPWBHNX-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCOC(=O)C1(CCN(C)CC1)c2ccc(Cl)c(Cl)c2
chemicalCompound:molecularF...	C15 H19 Cl2 N O2
chemicalCompound:moleculeId	182219
chemicalCompound:mwFreebase	316.223
chemicalCompound:alogp	3.774
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	29.54
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.493
chemicalCompound:acdLogD	3.256
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	316.223
chemicalCompound:acdMostBpk...	7.259
chemicalCompound:chemblId	CHEMBL326243
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:282219
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:85253, activity:85254, activity:85255