1145362

Source:http://linkedlifedata.com/resource/chembl/compound/1145362

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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:1153419
chemicalCompound:standardIn...	InChI=1S/C14H20N2.ClH/c1-6(15)16-14-9-4-2-7-11(9)12-8(13(7)14)3-5-10(12)14;/h7-13H,2-5H2,1H3,(H2,15,16);1H
chemicalCompound:standardIn...	GEONWMRWLFPZME-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CC(=N)NC12C3CCC4C3C5C(CCC15)C24
chemicalCompound:molecularF...	C14H21ClN2
chemicalCompound:moleculeId	1145362
chemicalCompound:mwFreebase	216.322
chemicalCompound:alogp	1.125
chemicalCompound:hba	1
chemicalCompound:hbd	2
chemicalCompound:psa	35.88
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	Y
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.767
chemicalCompound:acdLogD	0.768
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	252.783
chemicalCompound:acdMostBpk...	11.873
chemicalCompound:chemblId	CHEMBL1774316
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1245362
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:6197276, activity:6197293, activity:6197310, activity:6197327, activity:6197345, activity:6197362, activity:6197930