202088

Source:http://linkedlifedata.com/resource/chembl/compound/202088

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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/C25H28FN5O/c1-15(2)31-22-11-10-20(18-4-3-5-19(27)12-18)21(24(22)26)13-23(32)30-14-16-6-8-17(9-7-16)25(28)29/h3-12,15,31H,13-14,27H2,1-2H3,(H3,28,29)(H,30,32)
chemicalCompound:standardIn...	UIFFGJRELUIVDZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)Nc1ccc(c(CC(=O)NCc2ccc(cc2)C(=N)N)c1F)c3cccc(N)c3
chemicalCompound:molecularF...	C25 H28 F N5 O
chemicalCompound:moleculeId	202088
chemicalCompound:mwFreebase	433.521
chemicalCompound:alogp	3.225
chemicalCompound:hba	4
chemicalCompound:hbd	5
chemicalCompound:psa	117.02
chemicalCompound:rtb	8
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.275
chemicalCompound:acdLogD	1.277
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	433.521
chemicalCompound:acdMostBpk...	11.617
chemicalCompound:chemblId	CHEMBL125781
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:302088
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:947301, activity:947302, activity:947303, activity:1283461, activity:1283462, activity:1283463, activity:2066343