904203

Source:http://linkedlifedata.com/resource/chembl/compound/904203

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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/C15H20N4O4/c1-9-3-5-15(6-4-9)13(21)19(14(22)17-15)8-12(20)16-11-7-10(2)23-18-11/h7,9H,3-6,8H2,1-2H3,(H,17,22)(H,16,18,20)
chemicalCompound:standardIn...	XJEUTCMDVHQFJI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC1CCC2(CC1)NC(=O)N(CC(=O)Nc3cc(C)on3)C2=O
chemicalCompound:molecularF...	C15H20N4O4
chemicalCompound:moleculeId	904203
chemicalCompound:mwFreebase	320.344
chemicalCompound:alogp	1
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	104.54
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.005
chemicalCompound:acdLogP	2.233
chemicalCompound:acdLogD	2.232
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	320.344
chemicalCompound:chemblId	CHEMBL1480319
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1004203
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:3696873, activity:4523662, activity:4815554, activity:6463077, activity:6898748