771762

Source:http://linkedlifedata.com/resource/chembl/compound/771762

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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/C20H26N6O4/c1-13(2)26-15(21-17-16(26)19(28)23(4)20(29)22(17)3)12-24-7-9-25(10-8-24)18(27)14-6-5-11-30-14/h5-6,11,13H,7-10,12H2,1-4H3
chemicalCompound:standardIn...	QBTQPSOKXNMUJG-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)n1c(CN2CCN(CC2)C(=O)c3occc3)nc4N(C)C(=O)N(C)C(=O)c14
chemicalCompound:molecularF...	C20H26N6O4
chemicalCompound:moleculeId	771762
chemicalCompound:mwFreebase	414.458
chemicalCompound:alogp	1.169
chemicalCompound:hba	5
chemicalCompound:hbd	0
chemicalCompound:psa	95.12
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	1.476
chemicalCompound:acdLogD	1.475
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	414.458
chemicalCompound:acdMostBpk...	4.994
chemicalCompound:chemblId	CHEMBL1347878
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:871762
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:4089314, activity:5056422, activity:5413941, activity:5857358, activity:7141559, activity:8314002