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1108069
Source:
http://linkedlifedata.com/resource/chembl/compound/1108069
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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:1108069
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1108069
chemicalCompound:standardIn...
InChI=1S/C16H22O5/c17-9-7-12-10-13(18)15(19)16(20-12)8-3-5-11-4-1-2-6-14(11)21-16/h1-2,4,6,12-13,15,17-19H,3,5,7-10H2/t12-,13-,15+,16-/m1/s1
lld:chembl
chemicalCompound:1108069
chemicalCompound:standardIn...
JAQDGLMKQTUFFQ-LUYZLQTOSA-N
lld:chembl
chemicalCompound:1108069
chemicalCompound:canonicalS...
OCC[C@@H]1C[C@@H](O)[C@H](O)[C@]2(CCCc3ccccc3O2)O1
lld:chembl
chemicalCompound:1108069
chemicalCompound:molecularF...
C16H22O5
lld:chembl
chemicalCompound:1108069
chemicalCompound:moleculeId
1108069
lld:chembl
chemicalCompound:1108069
chemicalCompound:mwFreebase
294.343
lld:chembl
chemicalCompound:1108069
chemicalCompound:alogp
1
lld:chembl
chemicalCompound:1108069
chemicalCompound:hba
5
lld:chembl
chemicalCompound:1108069
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:1108069
chemicalCompound:psa
79.15
lld:chembl
chemicalCompound:1108069
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:1108069
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1108069
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1108069
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1108069
chemicalCompound:acdLogP
0.882
lld:chembl
chemicalCompound:1108069
chemicalCompound:acdLogD
0.882
lld:chembl
chemicalCompound:1108069
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:1108069
chemicalCompound:fullMwt
294.343
lld:chembl
chemicalCompound:1108069
chemicalCompound:chemblId
CHEMBL1727338
lld:chembl
chemicalCompound:1108069
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1108069
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1108069
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1108069
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1108069
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1108069
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1108069
chemicalCompound:activity
activity:5880181
lld:chembl
chemicalCompound:1108069
chemicalCompound:activity
activity:6633305
lld:chembl
chemicalCompound:1108069
chemicalCompound:activity
activity:7132771
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1108069
lld:chembl