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140033
Source:
http://linkedlifedata.com/resource/chembl/compound/140033
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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:140033
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:140033
chemicalCompound:standardIn...
InChI=1S/C11H9ClN2O2/c12-7-1-3-8(4-2-7)14-11(15)9-5-16-6-10(9)13-14/h1-4,15H,5-6H2
lld:chembl
chemicalCompound:140033
chemicalCompound:standardIn...
USAPWTXREZBRNI-UHFFFAOYSA-N
lld:chembl
chemicalCompound:140033
chemicalCompound:canonicalS...
Oc1c2COCc2nn1c3ccc(Cl)cc3
lld:chembl
chemicalCompound:140033
chemicalCompound:molecularF...
C11 H9 Cl N2 O2
lld:chembl
chemicalCompound:140033
chemicalCompound:moleculeId
140033
lld:chembl
chemicalCompound:140033
chemicalCompound:mwFreebase
236.654
lld:chembl
chemicalCompound:140033
chemicalCompound:alogp
2.376
lld:chembl
chemicalCompound:140033
chemicalCompound:hba
3
lld:chembl
chemicalCompound:140033
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:140033
chemicalCompound:psa
47.28
lld:chembl
chemicalCompound:140033
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:140033
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:140033
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:140033
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:140033
chemicalCompound:acdMostApk...
7.894
lld:chembl
chemicalCompound:140033
chemicalCompound:acdLogP
0.019
lld:chembl
chemicalCompound:140033
chemicalCompound:acdLogD
-0.104
lld:chembl
chemicalCompound:140033
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:140033
chemicalCompound:fullMwt
236.654
lld:chembl
chemicalCompound:140033
chemicalCompound:acdMostBpk...
2.202
lld:chembl
chemicalCompound:140033
chemicalCompound:chemblId
CHEMBL83458
lld:chembl
chemicalCompound:140033
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:140033
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:140033
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:140033
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:140033
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:140033
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:140033
chemicalCompound:oral
No
lld:chembl
chemicalCompound:140033
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:140033
chemicalCompound:topical
No
lld:chembl
chemicalCompound:140033
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:140033
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:140033
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:140033
chemicalCompound:activity
activity:303471
lld:chembl
chemicalCompound:140033
chemicalCompound:activity
activity:303472
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:140033
lld:chembl