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217918
Source:
http://linkedlifedata.com/resource/chembl/compound/217918
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:217918
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:217918
chemicalCompound:standardIn...
InChI=1S/C22H13NO3/c23-12-14-9-7-13(8-10-14)11-17-15-3-1-5-18(24)20(15)22(26)21-16(17)4-2-6-19(21)25/h1-11,24-25H
lld:chembl
chemicalCompound:217918
chemicalCompound:standardIn...
SLKLLNQYWRTDGS-UHFFFAOYSA-N
lld:chembl
chemicalCompound:217918
chemicalCompound:canonicalS...
Oc1cccc2C(=Cc3ccc(cc3)C#N)c4cccc(O)c4C(=O)c12
lld:chembl
chemicalCompound:217918
chemicalCompound:molecularF...
C22 H13 N O3
lld:chembl
chemicalCompound:217918
chemicalCompound:moleculeId
217918
lld:chembl
chemicalCompound:217918
chemicalCompound:mwFreebase
339.344
lld:chembl
chemicalCompound:217918
chemicalCompound:alogp
4.263
lld:chembl
chemicalCompound:217918
chemicalCompound:hba
4
lld:chembl
chemicalCompound:217918
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:217918
chemicalCompound:psa
81.32
lld:chembl
chemicalCompound:217918
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:217918
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:217918
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:217918
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:217918
chemicalCompound:acdMostApk...
6.937
lld:chembl
chemicalCompound:217918
chemicalCompound:acdLogP
4.649
lld:chembl
chemicalCompound:217918
chemicalCompound:acdLogD
3.96
lld:chembl
chemicalCompound:217918
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:217918
chemicalCompound:fullMwt
339.344
lld:chembl
chemicalCompound:217918
chemicalCompound:chemblId
CHEMBL130728
lld:chembl
chemicalCompound:217918
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:217918
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:217918
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:217918
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:217918
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:217918
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:217918
chemicalCompound:oral
No
lld:chembl
chemicalCompound:217918
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:217918
chemicalCompound:topical
No
lld:chembl
chemicalCompound:217918
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:217918
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:217918
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:217918
chemicalCompound:activity
activity:1159075
lld:chembl
chemicalCompound:217918
chemicalCompound:activity
activity:1159076
lld:chembl
chemicalCompound:217918
chemicalCompound:activity
activity:1159077
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:217918
lld:chembl