190330

Source:http://linkedlifedata.com/resource/chembl/compound/190330

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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/C19H12Cl3NO3/c20-11-2-4-15-12(8-11)19(25)18-16(23(15)26)6-10(7-17(18)24)9-1-3-13(21)14(22)5-9/h1-5,8,10,26H,6-7H2
chemicalCompound:standardIn...	UKEQLQYAEAYLCA-UHFFFAOYSA-N
chemicalCompound:canonicalS...	ON1C2=C(C(=O)CC(C2)c3ccc(Cl)c(Cl)c3)C(=O)c4cc(Cl)ccc14
chemicalCompound:molecularF...	C19 H12 Cl3 N O3
chemicalCompound:moleculeId	190330
chemicalCompound:mwFreebase	408.662
chemicalCompound:alogp	5.234
chemicalCompound:hba	4
chemicalCompound:hbd	1
chemicalCompound:psa	57.61
chemicalCompound:rtb	1
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	1
chemicalCompound:medChemFri...	N
chemicalCompound:acdMostApk...	4.384
chemicalCompound:acdLogP	3.982
chemicalCompound:acdLogD	1
chemicalCompound:molecularS...	molecularSpecies:ACID
chemicalCompound:fullMwt	408.662
chemicalCompound:chemblId	CHEMBL326765
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:290330
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:579800, activity:579801, activity:579802, activity:579803, activity:579804, activity:579805, activity:579806