757641

Source:http://linkedlifedata.com/resource/chembl/compound/757641

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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/C19H25FN4O/c1-3-15-11-18(23(2)22-15)19(25)21-16-8-6-10-24(13-16)12-14-7-4-5-9-17(14)20/h4-5,7,9,11,16H,3,6,8,10,12-13H2,1-2H3,(H,21,25)
chemicalCompound:standardIn...	OZDDBMXZMRPXND-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCc1cc(C(=O)NC2CCCN(Cc3ccccc3F)C2)n(C)n1
chemicalCompound:molecularF...	C19H25FN4O
chemicalCompound:moleculeId	757641
chemicalCompound:mwFreebase	344.426
chemicalCompound:alogp	3.346
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	50.16
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.113
chemicalCompound:acdLogD	2.248
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	344.426
chemicalCompound:acdMostBpk...	8.038
chemicalCompound:chemblId	CHEMBL1333757
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:857641
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:4100211, activity:4214005, activity:4810525, activity:5423314, activity:5650576, activity:5789066, activity:5889072, activity:5973932, activity:5983595, activity:6502055, activity:6633400, activity:6883333, activity:8269649