320588

Source:http://linkedlifedata.com/resource/chembl/compound/320588

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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/C16H9Cl3N2O2/c17-10-3-1-9(2-4-10)15-20-13(16(22)23)8-21(15)14-6-5-11(18)7-12(14)19/h1-8H,(H,22,23)
chemicalCompound:standardIn...	MFVXCYJFQJHNBS-UHFFFAOYSA-N
chemicalCompound:canonicalS...	OC(=O)c1cn(c2ccc(Cl)cc2Cl)c(n1)c3ccc(Cl)cc3
chemicalCompound:molecularF...	C16 H9 Cl3 N2 O2
chemicalCompound:moleculeId	320588
chemicalCompound:mwFreebase	367.614
chemicalCompound:alogp	5.476
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	55.12
chemicalCompound:rtb	3
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	3.603
chemicalCompound:acdLogP	5.141
chemicalCompound:acdLogD	2.138
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	367.614
chemicalCompound:chemblId	CHEMBL192498
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:420588
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:1501249, activity:1501250, activity:1501251