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223673
Source:
http://linkedlifedata.com/resource/chembl/compound/223673
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Subject
(
35
)
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Object
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Inference
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Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C11H15NO2/c1-12(2)10(11(13)14)8-9-6-4-3-5-7-9/h3-7,10H,8H2,1-2H3,(H,13,14)
chemicalCompound:standardIn...
HOGIQTACRLIOHC-UHFFFAOYSA-N
chemicalCompound:canonicalS...
CN(C)C(Cc1ccccc1)C(=O)O
chemicalCompound:molecularF...
C11 H15 N O2
chemicalCompound:moleculeId
223673
chemicalCompound:mwFreebase
193.242
chemicalCompound:alogp
-1.193
chemicalCompound:hba
3
chemicalCompound:hbd
1
chemicalCompound:psa
40.54
chemicalCompound:rtb
4
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
2.239
chemicalCompound:acdLogP
1
chemicalCompound:acdLogD
-1.501
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
chemicalCompound:fullMwt
193.242
chemicalCompound:acdMostBpk...
9.94
chemicalCompound:chemblId
CHEMBL336528
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:323673
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:693396