512575

Source:http://linkedlifedata.com/resource/chembl/compound/512575

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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/C17H14N2O4/c20-15(8-11-4-2-1-3-5-11)18-13-7-6-12-9-16(21)19(23)17(22)14(12)10-13/h1-7,10,23H,8-9H2,(H,18,20)
chemicalCompound:standardIn...	SDBYEHYJCQSIJI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	ON1C(=O)Cc2ccc(NC(=O)Cc3ccccc3)cc2C1=O
chemicalCompound:molecularF...	C17H14N2O4
chemicalCompound:moleculeId	512575
chemicalCompound:mwFreebase	310.304
chemicalCompound:alogp	1.523
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	86.71
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	7.386
chemicalCompound:acdLogP	0.759
chemicalCompound:acdLogD	0.458
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	310.304
chemicalCompound:chemblId	CHEMBL512021
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:612575
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:2595603, activity:2595624, activity:2595642, activity:2595658, activity:2595674, activity:2595682, activity:2595688, activity:2595694, activity:2595710