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87839
Source:
http://linkedlifedata.com/resource/chembl/compound/87839
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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:87839
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:87839
chemicalCompound:standardIn...
InChI=1S/C16H12N4O2/c21-15(22)11-3-1-5-13(9-11)19-16-18-8-6-14(20-16)12-4-2-7-17-10-12/h1-10H,(H,21,22)(H,18,19,20)
lld:chembl
chemicalCompound:87839
chemicalCompound:standardIn...
VXHBPYDHFUNZCG-UHFFFAOYSA-N
lld:chembl
chemicalCompound:87839
chemicalCompound:canonicalS...
OC(=O)c1cccc(Nc2nccc(n2)c3cccnc3)c1
lld:chembl
chemicalCompound:87839
chemicalCompound:molecularF...
C16 H12 N4 O2
lld:chembl
chemicalCompound:87839
chemicalCompound:moleculeId
87839
lld:chembl
chemicalCompound:87839
chemicalCompound:mwFreebase
292.292
lld:chembl
chemicalCompound:87839
chemicalCompound:alogp
1.911
lld:chembl
chemicalCompound:87839
chemicalCompound:hba
6
lld:chembl
chemicalCompound:87839
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:87839
chemicalCompound:psa
88
lld:chembl
chemicalCompound:87839
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:87839
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:87839
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:87839
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:87839
chemicalCompound:acdMostApk...
4.175
lld:chembl
chemicalCompound:87839
chemicalCompound:acdLogP
2.508
lld:chembl
chemicalCompound:87839
chemicalCompound:acdLogD
-0.343
lld:chembl
chemicalCompound:87839
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:87839
chemicalCompound:fullMwt
292.292
lld:chembl
chemicalCompound:87839
chemicalCompound:acdMostBpk...
2.687
lld:chembl
chemicalCompound:87839
chemicalCompound:chemblId
CHEMBL57556
lld:chembl
chemicalCompound:87839
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:87839
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:87839
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:87839
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:87839
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:87839
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:87839
chemicalCompound:oral
No
lld:chembl
chemicalCompound:87839
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:87839
chemicalCompound:topical
No
lld:chembl
chemicalCompound:87839
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:87839
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:87839
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913916
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913917
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913918
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913919
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913920
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913921
lld:chembl
chemicalCompound:87839
chemicalCompound:activity
activity:913922
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:87839
lld:chembl