239859

Source:http://linkedlifedata.com/resource/chembl/compound/239859

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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/C16H24N2O/c1-4-18(5-2)15(19)16(11-14(16)12(3)17)13-9-7-6-8-10-13/h6-10,12,14H,4-5,11,17H2,1-3H3/t12?,14-,16+/m1/s1
chemicalCompound:standardIn...	JZWQQSJMOZMVFS-TUJLOAKASA-N
chemicalCompound:canonicalS...	CCN(CC)C(=O)[C@@]1(C[C@@H]1C(C)N)c2ccccc2
chemicalCompound:molecularF...	C16 H24 N2 O
chemicalCompound:moleculeId	239859
chemicalCompound:mwFreebase	260.375
chemicalCompound:alogp	1.665
chemicalCompound:hba	2
chemicalCompound:hbd	1
chemicalCompound:psa	46.33
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.185
chemicalCompound:acdLogD	-1.754
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	260.375
chemicalCompound:acdMostBpk...	10.824
chemicalCompound:chemblId	CHEMBL145773
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:339859
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:364414, activity:364415, activity:364416, activity:364417, activity:379987, activity:379988, activity:379989, activity:379990