480577

Source:http://linkedlifedata.com/resource/chembl/compound/480577

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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/C19H26N2O/c1-4-20-14-18(22)19(16-8-6-5-7-9-16)21(3)17-12-10-15(2)11-13-17/h5-13,18-20,22H,4,14H2,1-3H3/t18-,19+/m1/s1
chemicalCompound:standardIn...	OQXFVNHXQYQZBS-MOPGFXCFSA-N
chemicalCompound:canonicalS...	CCNC[C@@H](O)[C@@H](N(C)c1ccc(C)cc1)c2ccccc2
chemicalCompound:molecularF...	C19H26N2O
chemicalCompound:moleculeId	480577
chemicalCompound:mwFreebase	298.423
chemicalCompound:alogp	3.531
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	35.5
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.407
chemicalCompound:acdLogD	1.977
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	298.423
chemicalCompound:acdMostBpk...	8.677
chemicalCompound:chemblId	CHEMBL467124
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:580577
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:2522756