769925

Source:http://linkedlifedata.com/resource/chembl/compound/769925

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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/C25H33N5O4/c1-7-33-24(32)14-22(19-8-10-20(11-9-19)34-15(2)3)28-23(31)13-12-21-16(4)26-25-27-18(6)29-30(25)17(21)5/h8-11,15,22H,7,12-14H2,1-6H3,(H,28,31)
chemicalCompound:standardIn...	RZCFCHXZAITMBD-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CCOC(=O)CC(NC(=O)CCc1c(C)nc2nc(C)nn2c1C)c3ccc(OC(C)C)cc3
chemicalCompound:molecularF...	C25H33N5O4
chemicalCompound:moleculeId	769925
chemicalCompound:mwFreebase	467.561
chemicalCompound:alogp	3.086
chemicalCompound:hba	7
chemicalCompound:hbd	1
chemicalCompound:psa	107.71
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	3.343
chemicalCompound:acdLogD	3.343
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	467.561
chemicalCompound:acdMostBpk...	2.549
chemicalCompound:chemblId	CHEMBL1346041
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:869925
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:4150993, activity:5044374, activity:5413905, activity:5569724, activity:5573382, activity:5856375, activity:6712597, activity:6733369, activity:8313964