752395

Source:http://linkedlifedata.com/resource/chembl/compound/752395

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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/C24H28N2O6/c1-5-32-24(29)17-7-9-18(10-8-17)26-22(27)15-19(23(26)28)25(2)13-12-16-6-11-20(30-3)21(14-16)31-4/h6-11,14,19H,5,12-13,15H2,1-4H3
chemicalCompound:standardIn...	IRBACUXAMQGEEZ-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCOC(=O)c1ccc(cc1)N2C(=O)CC(N(C)CCc3ccc(OC)c(OC)c3)C2=O
chemicalCompound:molecularF...	C24H28N2O6
chemicalCompound:moleculeId	752395
chemicalCompound:mwFreebase	440.489
chemicalCompound:alogp	3.092
chemicalCompound:hba	7
chemicalCompound:hbd	0
chemicalCompound:psa	85.38
chemicalCompound:rtb	10
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.265
chemicalCompound:acdLogD	3.261
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	440.489
chemicalCompound:acdMostBpk...	5.323
chemicalCompound:chemblId	CHEMBL1328511
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:852395
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:3982117, activity:4009138, activity:4129906, activity:4299856, activity:4412150, activity:5573335, activity:5684848, activity:6577256, activity:6647601, activity:6728800, activity:7161647, activity:7410613, activity:7453844, activity:7547604