1159076

Source:http://linkedlifedata.com/resource/chembl/compound/1159076

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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/C24H28ClN3O2/c25-21-9-4-5-10-22(21)27-15-13-26(14-16-27)11-6-12-28-23(29)17-20(18-24(28)30)19-7-2-1-3-8-19/h1-5,7-10,20H,6,11-18H2
chemicalCompound:standardIn...	ODTONMYKXOZWKB-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Clc1ccccc1N2CCN(CCCN3C(=O)CC(CC3=O)c4ccccc4)CC2
chemicalCompound:molecularF...	C24H28ClN3O2
chemicalCompound:moleculeId	1159076
chemicalCompound:mwFreebase	425.951
chemicalCompound:alogp	3.648
chemicalCompound:hba	4
chemicalCompound:hbd	0
chemicalCompound:psa	43.86
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.503
chemicalCompound:acdLogD	3.394
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	425.951
chemicalCompound:acdMostBpk...	7.49
chemicalCompound:chemblId	CHEMBL1796031
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1259076
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:6264400, activity:6264401, activity:6264402