705868

Source:http://linkedlifedata.com/resource/chembl/compound/705868

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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:4634
chemicalCompound:standardIn...	InChI=1S/C23H26FN3O2.ClH/c24-19-10-8-18(9-11-19)21(28)7-4-14-26-15-12-23(13-16-26)22(29)25-17-27(23)20-5-2-1-3-6-20;/h1-3,5-6,8-11H,4,7,12-17H2,(H,25,29);1H
chemicalCompound:standardIn...	QUIKMLCZZMOBLH-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.Fc1ccc(cc1)C(=O)CCCN2CCC3(CC2)N(CNC3=O)c4ccccc4
chemicalCompound:molecularF...	C23H27ClFN3O2
chemicalCompound:moleculeId	705868
chemicalCompound:mwFreebase	395.47
chemicalCompound:alogp	3.064
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	52.65
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.248
chemicalCompound:acdLogD	1.76
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	431.931
chemicalCompound:acdMostBpk...	8.888
chemicalCompound:chemblId	CHEMBL1256875
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:805868
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:3481332, activity:3481338, activity:3481382, activity:3481444, activity:3481478, activity:3481547, activity:3482510, activity:3490953, activity:3634115, activity:3696178, activity:3989037, activity:4278718, activity:4358510, activity:4536018, activity:4538355, activity:4749869, activity:4905001, activity:4929962, activity:4970371, activity:5029192, activity:5065068, activity:5569939, activity:5693842, activity:6797246, activity:7005019, activity:7530075