1354

Source:http://linkedlifedata.com/resource/chembl/compound/1354

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:synonym	synonym:1354_Betaxolol_FDA_ALTERNATIVE_NAME, synonym:1354_Betaxolol_INN, synonym:1354_Betoptic S_TRADE_NAME, synonym:1354_Betoptic_OTHER, synonym:1354_Kerledex_OTHER, synonym:1354_Kerlone_OTHER, synonym:1354_Kerlone_TRADE_NAME
chemicalCompound:standardIn...	InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3
chemicalCompound:standardIn...	NWIUTZDMDHAVTP-UHFFFAOYSA-N
chemicalCompound:canonicalS...	CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1
chemicalCompound:molecularF...	C18H29NO3
chemicalCompound:moleculeId	1354
chemicalCompound:mwFreebase	307.428
chemicalCompound:alogp	2.577
chemicalCompound:hba	4
chemicalCompound:hbd	2
chemicalCompound:psa	50.72
chemicalCompound:rtb	11
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	0
chemicalCompound:medChemFri...	Y
chemicalCompound:acdMostApk...	13.891
chemicalCompound:acdLogP	2.532
chemicalCompound:acdLogD	0.431
chemicalCompound:molecularS...	molecularSpecies:BASE
chemicalCompound:fullMwt	307.428
chemicalCompound:acdMostBpk...	9.434
chemicalCompound:chemblId	CHEMBL423
chemicalCompound:maxPhase	4
chemicalCompound:therapeuti...	1
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:101354
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	BETAXOLOL
chemicalCompound:chebiParen...	https://linkedlifedata.com/resource/chebi/id/CHEBI:3082
chemicalCompound:firstAppro...	1985
chemicalCompound:activity	activity:61754, activity:61755, activity:61756, activity:128058, activity:128059, activity:128060, activity:128061, activity:128062, activity:433971, activity:446858, activity:446859, activity:446860, activity:497419, activity:497420, activity:518399, activity:518400, activity:518401, activity:858113, activity:858114, activity:858115, activity:898895, activity:898896, activity:898897, activity:898898, activity:954026, activity:995654, activity:995655, activity:995656, activity:995657, activity:1017045, activity:1017046, activity:1017047, activity:1017048, activity:1055287, activity:1055288, activity:1055289, activity:1423598, activity:1423599, activity:2589702, activity:2671409, activity:2671410, activity:2978219, activity:2979649, activity:2979711, activity:2979804, activity:2992047, activity:2993388, activity:2994787, activity:2994796, activity:2996407, activity:3264633, activity:3667470, activity:5080256, activity:5082011, activity:5082303, activity:5083254