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9808
Source:
http://linkedlifedata.com/resource/chembl/compound/9808
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Subject
Predicate
Object
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(
34
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:9808
chemicalCompound:standardIn...
InChI=1S/C14H17N3O/c18-14-16-12-3-1-2-10-6-11(8-17(14)13(10)12)15-7-9-4-5-9/h1-3,9,11,15H,4-8H2,(H,16,18)
lld:chembl
chemicalCompound:9808
chemicalCompound:standardIn...
BZPXXRXAIGZHIA-UHFFFAOYSA-N
lld:chembl
chemicalCompound:9808
chemicalCompound:canonicalS...
Oc1nc2cccc3CC(Cn1c23)NCC4CC4
lld:chembl
chemicalCompound:9808
chemicalCompound:molecularF...
C14 H17 N3 O
lld:chembl
chemicalCompound:9808
chemicalCompound:moleculeId
9808
lld:chembl
chemicalCompound:9808
chemicalCompound:mwFreebase
243.304
lld:chembl
chemicalCompound:9808
chemicalCompound:alogp
2.377
lld:chembl
chemicalCompound:9808
chemicalCompound:hba
3
lld:chembl
chemicalCompound:9808
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:9808
chemicalCompound:psa
50.08
lld:chembl
chemicalCompound:9808
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:9808
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:9808
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:9808
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:9808
chemicalCompound:acdMostApk...
0.949
lld:chembl
chemicalCompound:9808
chemicalCompound:acdLogP
2.424
lld:chembl
chemicalCompound:9808
chemicalCompound:acdLogD
-0.746
lld:chembl
chemicalCompound:9808
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
lld:chembl
chemicalCompound:9808
chemicalCompound:fullMwt
243.304
lld:chembl
chemicalCompound:9808
chemicalCompound:acdMostBpk...
9.866
lld:chembl
chemicalCompound:9808
chemicalCompound:chemblId
CHEMBL276468
lld:chembl
chemicalCompound:9808
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:9808
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:9808
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:9808
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:9808
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:9808
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:9808
chemicalCompound:oral
No
lld:chembl
chemicalCompound:9808
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:9808
chemicalCompound:topical
No
lld:chembl
chemicalCompound:9808
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:9808
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:9808
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:676363
chemicalCompound:parent
chemicalCompound:9808
lld:chembl