265667

Source:http://linkedlifedata.com/resource/chembl/compound/265667

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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/C22H26N4O2S/c1-28-16-21(27)26(20-9-5-8-19-22(20)24-29-23-19)18-11-14-25(15-12-18)13-10-17-6-3-2-4-7-17/h2-9,18H,10-16H2,1H3
chemicalCompound:standardIn...	QOTQOLUTSZJLBV-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COCC(=O)N(C1CCN(CCc2ccccc2)CC1)c3cccc4nsnc34
chemicalCompound:molecularF...	C22 H26 N4 O2 S
chemicalCompound:moleculeId	265667
chemicalCompound:mwFreebase	410.532
chemicalCompound:alogp	3.036
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	86.8
chemicalCompound:rtb	7
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	2.637
chemicalCompound:acdLogD	1.287
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	410.532
chemicalCompound:acdMostBpk...	8.742
chemicalCompound:chemblId	CHEMBL441103
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:365667
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:47412, activity:47413, activity:47414, activity:47415, activity:47416, activity:47417, activity:47418