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174221
Source:
http://linkedlifedata.com/resource/chembl/compound/174221
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Subject
(
32
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C14H14N/c1-15-11-9-14(10-12-15)8-7-13-5-3-2-4-6-13/h2-12H,1H3/q+1/b8-7+
chemicalCompound:standardIn...
YVXDRFYHWWPSOA-BQYQJAHWSA-N
chemicalCompound:canonicalS...
C[n+]1ccc(\C=C\c2ccccc2)cc1
chemicalCompound:molecularF...
C14 H14 N
chemicalCompound:moleculeId
174221
chemicalCompound:mwFreebase
196.268
chemicalCompound:alogp
3.42
chemicalCompound:hba
0
chemicalCompound:hbd
0
chemicalCompound:psa
3.88
chemicalCompound:rtb
2
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
-0.491
chemicalCompound:acdLogD
-0.491
chemicalCompound:fullMwt
196.268
chemicalCompound:chemblId
CHEMBL106928
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:274221
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:528131