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Sources
543228
Source:
http://linkedlifedata.com/resource/chembl/compound/543228
Search
Subject
(
79
)
Predicate
Object
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:parent
chemicalCompound:1354
chemicalCompound:synonym
synonym:543228_ALO-1401-02_RESEARCH_CODE
,
synonym:543228_Betaxolol Hydrochloride_JAN
,
synonym:543228_Betaxolol Hydrochloride_USAN
,
synonym:543228_Betaxolol Hydrochloride_USP
,
synonym:543228_Betaxolol hydrochloride_FDA_ALTERNATIVE_NAME
,
synonym:543228_Betaxolol hydrochloride_TRADE_NAME
,
synonym:543228_Betaxolol_BAN
,
synonym:543228_Betaxolol_INN
,
synonym:543228_Betaxolol_TRADE_NAME
,
synonym:543228_Betoptic s_TRADE_NAME
,
synonym:543228_Betoptic_TRADE_NAME
,
synonym:543228_Kerlone_TRADE_NAME
,
synonym:543228_SL-75212-10_RESEARCH_CODE
chemicalCompound:standardIn...
InChI=1S/C18H29NO3.ClH/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;1H
chemicalCompound:standardIn...
CHDPSNLJFOQTRK-UHFFFAOYSA-N
chemicalCompound:canonicalS...
Cl.CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1
chemicalCompound:molecularF...
C18H30ClNO3
chemicalCompound:moleculeId
543228
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
343.889
chemicalCompound:acdMostBpk...
9.434
chemicalCompound:chemblId
CHEMBL1691
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
Yes
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:643228
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 HYDROCHLORIDE
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:643228
chemicalCompound:firstAppro...
1985
chemicalCompound:activity
activity:989689
,
activity:989690
,
activity:989691
,
activity:989692
,
activity:989693
,
activity:989694
,
activity:989695
,
activity:989696
,
activity:989697
,
activity:3473932
,
activity:3484578
,
activity:3489266
,
activity:3489345
,
activity:3648035
,
activity:3987907
,
activity:4278386
,
activity:4404029
,
activity:4535709
,
activity:4628837
,
activity:4741984
,
activity:4913884
,
activity:5769338
,
activity:5855699
,
activity:6801250
,
activity:6918262
,
activity:7005107
,
activity:7210094
,
activity:7495335