674953

Source:http://linkedlifedata.com/resource/chembl/compound/674953

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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:62182
chemicalCompound:synonym	synonym:674953_Carteolol Hydrochloride_JAN, synonym:674953_Carteolol Hydrochloride_USAN, synonym:674953_Carteolol_BAN, synonym:674953_Carteolol_INN, synonym:674953_OPC-1085_RESEARCH_CODE
chemicalCompound:standardIn...	InChI=1S/C16H24N2O3.ClH/c1-16(2,3)17-9-11(19)10-21-14-6-4-5-13-12(14)7-8-15(20)18-13;/h4-6,11,17,19H,7-10H2,1-3H3,(H,18,20);1H
chemicalCompound:standardIn...	FYBXRCFPOTXTJF-UHFFFAOYSA-N
chemicalCompound:canonicalS...	Cl.CC(C)(C)NCC(O)COc1cccc2NC(=O)CCc12
chemicalCompound:molecularF...	C16H25ClN2O3
chemicalCompound:moleculeId	674953
chemicalCompound:mwFreebase	292.373
chemicalCompound:alogp	1.282
chemicalCompound:hba	4
chemicalCompound:hbd	3
chemicalCompound:psa	70.59
chemicalCompound:rtb	6
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.839
chemicalCompound:acdLogP	1.34
chemicalCompound:acdLogD	-0.737
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	328.834
chemicalCompound:acdMostBpk...	9.518
chemicalCompound:chemblId	CHEMBL1201002
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	Yes
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:774953
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	Yes
chemicalCompound:parenteral	No
chemicalCompound:topical	Yes
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:prefName	CARTEOLOL HYDROCHLORIDE
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:3438
chemicalCompound:firstAppro...	1988
chemicalCompound:activity	activity:7036919