135586

Source:http://linkedlifedata.com/resource/chembl/compound/135586

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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/C20H24N2O/c1-14-7-6-9-16-11-15-8-4-5-10-18(15)22-19(20(14)16)12-17(23-22)13-21(2)3/h4-10,17,19H,11-13H2,1-3H3
chemicalCompound:standardIn...	ZTXJDBYCWAXXCA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CN(C)CC1CC2N(O1)c3ccccc3Cc4cccc(C)c24
chemicalCompound:molecularF...	C20 H24 N2 O
chemicalCompound:moleculeId	135586
chemicalCompound:mwFreebase	308.417
chemicalCompound:alogp	4.146
chemicalCompound:hba	3
chemicalCompound:hbd	0
chemicalCompound:psa	15.71
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.196
chemicalCompound:acdLogD	1.765
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	308.417
chemicalCompound:acdMostBpk...	8.682
chemicalCompound:chemblId	CHEMBL314795
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:235586
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:1158876, activity:1158877, activity:1158878, activity:1158879, activity:1158880