370381

Source:http://linkedlifedata.com/resource/chembl/compound/370381

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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/C25H17N3O2/c29-23(21-16-15-17-9-7-8-14-20(17)26-21)28-25-22(18-10-3-1-4-11-18)27-24(30-25)19-12-5-2-6-13-19/h1-16H,(H,28,29)
chemicalCompound:standardIn...	OVQBURFQBODXME-UHFFFAOYSA-N
chemicalCompound:canonicalS...	O=C(Nc1oc(nc1c2ccccc2)c3ccccc3)c4ccc5ccccc5n4
chemicalCompound:molecularF...	C25 H17 N3 O2
chemicalCompound:moleculeId	370381
chemicalCompound:mwFreebase	391.421
chemicalCompound:alogp	5.123
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	68.02
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	9.628
chemicalCompound:acdLogP	5.697
chemicalCompound:acdLogD	5.694
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	391.421
chemicalCompound:acdMostBpk...	1
chemicalCompound:chemblId	CHEMBL223854
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:470381
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:1818999, activity:1821747, activity:1821787