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48453
Source:
http://linkedlifedata.com/resource/chembl/compound/48453
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Subject
Predicate
Object
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(
36
)
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Inference
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Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:48453
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:48453
chemicalCompound:standardIn...
InChI=1S/C18H13ClN2O3/c1-11-16(10-12-2-8-15(22)9-3-12)18(24)21(20-11)17(23)13-4-6-14(19)7-5-13/h2-10,22H,1H3/b16-10-
lld:chembl
chemicalCompound:48453
chemicalCompound:standardIn...
KHDVRSANQYOYDA-YBEGLDIGSA-N
lld:chembl
chemicalCompound:48453
chemicalCompound:canonicalS...
CC1=NN(C(=O)c2ccc(Cl)cc2)C(=O)/C/1=C\c3ccc(O)cc3
lld:chembl
chemicalCompound:48453
chemicalCompound:molecularF...
C18 H13 Cl N2 O3
lld:chembl
chemicalCompound:48453
chemicalCompound:moleculeId
48453
lld:chembl
chemicalCompound:48453
chemicalCompound:mwFreebase
340.76
lld:chembl
chemicalCompound:48453
chemicalCompound:alogp
3.328
lld:chembl
chemicalCompound:48453
chemicalCompound:hba
4
lld:chembl
chemicalCompound:48453
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:48453
chemicalCompound:psa
69.97
lld:chembl
chemicalCompound:48453
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:48453
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:48453
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:48453
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:48453
chemicalCompound:acdMostApk...
8.937
lld:chembl
chemicalCompound:48453
chemicalCompound:acdLogP
2.674
lld:chembl
chemicalCompound:48453
chemicalCompound:acdLogD
2.662
lld:chembl
chemicalCompound:48453
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:48453
chemicalCompound:fullMwt
340.76
lld:chembl
chemicalCompound:48453
chemicalCompound:chemblId
CHEMBL441600
lld:chembl
chemicalCompound:48453
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:48453
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:48453
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:48453
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:48453
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:48453
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:48453
chemicalCompound:oral
No
lld:chembl
chemicalCompound:48453
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:48453
chemicalCompound:topical
No
lld:chembl
chemicalCompound:48453
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:48453
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:48453
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:48453
chemicalCompound:prefName
PYROGLUTAMIC ACID
lld:chembl
chemicalCompound:48453
chemicalCompound:activity
activity:967239
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:48453
lld:chembl