1051131

Source:http://linkedlifedata.com/resource/chembl/compound/1051131

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:parent	chemicalCompound:67617
chemicalCompound:synonym	synonym:1051131_CL-40881_RESEARCH_CODE, synonym:1051131_Ethambutol Hydrochloride_JAN, synonym:1051131_Ethambutol Hydrochloride_USAN, synonym:1051131_Ethambutol_BAN, synonym:1051131_Ethambutol_INN
chemicalCompound:standardIn...	InChI=1S/C10H24N2O2.ClH/c1-3-9(7-13)11-5-6-12-10(4-2)8-14;/h9-14H,3-8H2,1-2H3;1H/t9-,10-;/m0./s1
chemicalCompound:standardIn...	ZVRRAFGIXXGENK-IYPAPVHQSA-N
chemicalCompound:canonicalS...	Cl.CC[C@@H](CO)NCCN[C@@H](CC)CO
chemicalCompound:molecularF...	C10H25ClN2O2
chemicalCompound:moleculeId	1051131
chemicalCompound:mwFreebase	204.31
chemicalCompound:alogp	0.11
chemicalCompound:hba	4
chemicalCompound:hbd	4
chemicalCompound:psa	64.52
chemicalCompound:rtb	9
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	-0.291
chemicalCompound:acdLogD	-2.572
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	240.771
chemicalCompound:acdMostBpk...	9.593
chemicalCompound:chemblId	CHEMBL1628240
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:1151131
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	ETHAMBUTOL HYDROCHLORIDE
chemicalCompound:activity	activity:7988755, activity:7988808, activity:7988861, activity:7989790