1243736

Source:http://linkedlifedata.com/resource/chembl/compound/1243736

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:1247531
chemicalCompound:standardIn...	InChI=1S/C19H24N2.ClH/c1-15-9-8-10-16(2)18(15)19(20-13-14-21(3)4)17-11-6-5-7-12-17;/h5-12H,13-14H2,1-4H3;1H
chemicalCompound:standardIn...	SYZVXYVWEXVXBQ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CN(C)CCN=C(c1ccccc1)c2c(C)cccc2C
chemicalCompound:molecularF...	C19H25ClN2
chemicalCompound:moleculeId	1243736
chemicalCompound:mwFreebase	280.407
chemicalCompound:alogp	4.605
chemicalCompound:hba	2
chemicalCompound:hbd	0
chemicalCompound:psa	15.6
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.403
chemicalCompound:acdLogD	0.41
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	316.868
chemicalCompound:acdMostBpk...	9.131
chemicalCompound:chemblId	CHEMBL1903165
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1343736
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:7224774, activity:7322409, activity:7452410