1208351

Source:http://linkedlifedata.com/resource/chembl/compound/1208351

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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/C17H16Br2O3/c1-11(2)22-16(20)17(21,12-3-7-14(18)8-4-12)13-5-9-15(19)10-6-13/h3-11,21H,1-2H3
chemicalCompound:standardIn...	FOANIXZHAMJWOI-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)OC(=O)C(O)(c1ccc(Br)cc1)c2ccc(Br)cc2
chemicalCompound:molecularF...	C17H16Br2O3
chemicalCompound:moleculeId	1208351
chemicalCompound:mwFreebase	428.115
chemicalCompound:alogp	4.837
chemicalCompound:hba	3
chemicalCompound:hbd	1
chemicalCompound:psa	46.53
chemicalCompound:rtb	5
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	11.175
chemicalCompound:acdLogP	5.376
chemicalCompound:acdLogD	5.376
chemicalCompound:molecularS...	molecularSpecies:NEUTRAL
chemicalCompound:fullMwt	428.115
chemicalCompound:chemblId	CHEMBL1867780
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1308351
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:6446999, activity:6562322, activity:6581044, activity:7011305, activity:7022437, activity:7048562, activity:7059181, activity:7224226, activity:7460790, activity:7550051