1250184

Source:http://linkedlifedata.com/resource/chembl/compound/1250184

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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/C18H15ClN2O3/c1-21-10-15(14-8-3-11(19)9-16(14)21)17(22)18(23)20-12-4-6-13(24-2)7-5-12/h3-10H,1-2H3,(H,20,23)
chemicalCompound:standardIn...	LUYHWGQIFGITMO-UHFFFAOYSA-N
chemicalCompound:canonicalS...	COc1ccc(NC(=O)C(=O)c2cn(C)c3cc(Cl)ccc23)cc1
chemicalCompound:molecularF...	C18H15ClN2O3
chemicalCompound:moleculeId	1250184
chemicalCompound:mwFreebase	342.776
chemicalCompound:alogp	3.647
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	60.33
chemicalCompound:rtb	4
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	10.109
chemicalCompound:acdLogP	2.748
chemicalCompound:acdLogD	2.747
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	342.776
chemicalCompound:acdMostBpk...	1
chemicalCompound:chemblId	CHEMBL1910589
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1350184
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:7854440, activity:7855408, activity:7855464, activity:7855510