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294539
Source:
http://linkedlifedata.com/resource/chembl/compound/294539
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Subject
Predicate
Object
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(
35
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:294539
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:294539
chemicalCompound:standardIn...
InChI=1S/C25H19ClO6/c1-30-19-9-4-16(5-10-19)24(27)20(12-15-2-7-18(26)8-3-15)23(25(28)29)17-6-11-21-22(13-17)32-14-31-21/h2-11,13H,12,14H2,1H3,(H,28,29)/b23-20-
lld:chembl
chemicalCompound:294539
chemicalCompound:standardIn...
KJMNYKCMEMNAJP-ATJXCDBQSA-N
lld:chembl
chemicalCompound:294539
chemicalCompound:canonicalS...
COc1ccc(cc1)C(=O)\C(=C(/C(=O)O)\c2ccc3OCOc3c2)\Cc4ccc(Cl)cc4
lld:chembl
chemicalCompound:294539
chemicalCompound:molecularF...
C25 H19 Cl O6
lld:chembl
chemicalCompound:294539
chemicalCompound:moleculeId
294539
lld:chembl
chemicalCompound:294539
chemicalCompound:mwFreebase
450.868
lld:chembl
chemicalCompound:294539
chemicalCompound:alogp
5.642
lld:chembl
chemicalCompound:294539
chemicalCompound:hba
6
lld:chembl
chemicalCompound:294539
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:294539
chemicalCompound:psa
82.06
lld:chembl
chemicalCompound:294539
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:294539
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:294539
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:294539
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:294539
chemicalCompound:acdMostApk...
2.433
lld:chembl
chemicalCompound:294539
chemicalCompound:acdLogP
5.603
lld:chembl
chemicalCompound:294539
chemicalCompound:acdLogD
1.879
lld:chembl
chemicalCompound:294539
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:294539
chemicalCompound:fullMwt
450.868
lld:chembl
chemicalCompound:294539
chemicalCompound:chemblId
CHEMBL366442
lld:chembl
chemicalCompound:294539
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:294539
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:294539
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:294539
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:294539
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:294539
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:294539
chemicalCompound:oral
No
lld:chembl
chemicalCompound:294539
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:294539
chemicalCompound:topical
No
lld:chembl
chemicalCompound:294539
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:294539
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:294539
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:294539
chemicalCompound:activity
activity:975596
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:294539
lld:chembl