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547137
Source:
http://linkedlifedata.com/resource/chembl/compound/547137
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Subject
Predicate
Object
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(
42
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:547137
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:547137
chemicalCompound:parent
chemicalCompound:665961
lld:chembl
chemicalCompound:547137
chemicalCompound:standardIn...
InChI=1S/C20H15F3N2O3.ClH/c21-10-1-3-11(4-2-10)24-8-14-16(22)7-13-18(17(14)23)25(12-5-6-12)9-15(19(13)26)20(27)28;/h1-4,7,9,12,24H,5-6,8H2,(H,27,28);1H
lld:chembl
chemicalCompound:547137
chemicalCompound:standardIn...
WTLARKIXFHNXOX-UHFFFAOYSA-N
lld:chembl
chemicalCompound:547137
chemicalCompound:canonicalS...
Cl.OC(=O)C1=CN(C2CC2)c3c(F)c(CNc4ccc(F)cc4)c(F)cc3C1=O
lld:chembl
chemicalCompound:547137
chemicalCompound:molecularF...
C20H16ClF3N2O3
lld:chembl
chemicalCompound:547137
chemicalCompound:moleculeId
547137
lld:chembl
chemicalCompound:547137
chemicalCompound:mwFreebase
388.34
lld:chembl
chemicalCompound:547137
chemicalCompound:alogp
3.655
lld:chembl
chemicalCompound:547137
chemicalCompound:hba
5
lld:chembl
chemicalCompound:547137
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:547137
chemicalCompound:psa
69.64
lld:chembl
chemicalCompound:547137
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:547137
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:547137
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:547137
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:547137
chemicalCompound:acdMostApk...
6.373
lld:chembl
chemicalCompound:547137
chemicalCompound:acdLogP
0.492
lld:chembl
chemicalCompound:547137
chemicalCompound:acdLogD
-0.573
lld:chembl
chemicalCompound:547137
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:547137
chemicalCompound:fullMwt
424.801
lld:chembl
chemicalCompound:547137
chemicalCompound:acdMostBpk...
2.999
lld:chembl
chemicalCompound:547137
chemicalCompound:chemblId
CHEMBL543187
lld:chembl
chemicalCompound:547137
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:547137
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:547137
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:547137
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:547137
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:547137
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:547137
chemicalCompound:oral
No
lld:chembl
chemicalCompound:547137
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:547137
chemicalCompound:topical
No
lld:chembl
chemicalCompound:547137
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:547137
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:547137
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739244
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739245
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739246
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739247
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739248
lld:chembl
chemicalCompound:547137
chemicalCompound:activity
activity:739249
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:547137
lld:chembl