932762

Source:http://linkedlifedata.com/resource/chembl/compound/932762

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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/C12H12N2O3/c1-17-9-4-2-8(3-5-9)6-10-12(16)13-7-11(15)14-10/h2-6H,7H2,1H3,(H,13,16)(H,14,15)/b10-6+
chemicalCompound:standardIn...	QDPUYZBFCQWKBG-UXBLZVDNSA-N
chemicalCompound:canonicalS...	COc1ccc(\C=C/2\NC(=O)CNC2=O)cc1
chemicalCompound:molecularF...	C12H12N2O3
chemicalCompound:moleculeId	932762
chemicalCompound:mwFreebase	232.235
chemicalCompound:alogp	0
chemicalCompound:hba	3
chemicalCompound:hbd	2
chemicalCompound:psa	67.43
chemicalCompound:rtb	2
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	11.776
chemicalCompound:acdLogP	1.048
chemicalCompound:acdLogD	1.048
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	232.235
chemicalCompound:chemblId	CHEMBL1508878
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1032762
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:4312921, activity:4366038, activity:5716352, activity:5816104