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340113
Source:
http://linkedlifedata.com/resource/chembl/compound/340113
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Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:340113
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:340113
chemicalCompound:standardIn...
InChI=1S/C22H18FN5O3/c23-15-5-3-14(4-6-15)13-25-20-17(2-1-9-24-20)21-27-28-22(31-21)26-16-7-8-18-19(12-16)30-11-10-29-18/h1-9,12H,10-11,13H2,(H,24,25)(H,26,28)
lld:chembl
chemicalCompound:340113
chemicalCompound:standardIn...
QNSXSZFJLUWKGW-UHFFFAOYSA-N
lld:chembl
chemicalCompound:340113
chemicalCompound:canonicalS...
Fc1ccc(CNc2ncccc2c3oc(Nc4ccc5OCCOc5c4)nn3)cc1
lld:chembl
chemicalCompound:340113
chemicalCompound:molecularF...
C22 H18 F N5 O3
lld:chembl
chemicalCompound:340113
chemicalCompound:moleculeId
340113
lld:chembl
chemicalCompound:340113
chemicalCompound:mwFreebase
419.408
lld:chembl
chemicalCompound:340113
chemicalCompound:alogp
3.355
lld:chembl
chemicalCompound:340113
chemicalCompound:hba
7
lld:chembl
chemicalCompound:340113
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:340113
chemicalCompound:psa
94.33
lld:chembl
chemicalCompound:340113
chemicalCompound:rtb
6
lld:chembl
chemicalCompound:340113
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:340113
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:340113
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:340113
chemicalCompound:acdLogP
3.57
lld:chembl
chemicalCompound:340113
chemicalCompound:acdLogD
3.57
lld:chembl
chemicalCompound:340113
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:340113
chemicalCompound:fullMwt
419.408
lld:chembl
chemicalCompound:340113
chemicalCompound:acdMostBpk...
3.329
lld:chembl
chemicalCompound:340113
chemicalCompound:chemblId
CHEMBL204811
lld:chembl
chemicalCompound:340113
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:340113
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:340113
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:340113
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:340113
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:340113
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:340113
chemicalCompound:oral
No
lld:chembl
chemicalCompound:340113
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:340113
chemicalCompound:topical
No
lld:chembl
chemicalCompound:340113
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:340113
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:340113
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:340113
chemicalCompound:activity
activity:1686152
lld:chembl
chemicalCompound:340113
chemicalCompound:activity
activity:1686190
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:340113
lld:chembl