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190957
Source:
http://linkedlifedata.com/resource/chembl/compound/190957
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Subject
(
37
)
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Inference
Explicit and implicit
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Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C2H3F3O/c3-2(4,5)1-6/h6H,1H2
chemicalCompound:standardIn...
RHQDFWAXVIIEBN-UHFFFAOYSA-N
chemicalCompound:canonicalS...
OCC(F)(F)F
chemicalCompound:molecularF...
C2H3F3O
chemicalCompound:moleculeId
190957
chemicalCompound:mwFreebase
100.04
chemicalCompound:alogp
0.649
chemicalCompound:hba
1
chemicalCompound:hbd
1
chemicalCompound:psa
20.23
chemicalCompound:rtb
1
chemicalCompound:ro3Pass
Y
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
12.463
chemicalCompound:acdLogP
0.202
chemicalCompound:acdLogD
0.202
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
100.04
chemicalCompound:chemblId
CHEMBL116675
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:290957
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
TRIFLUOROETHANOL
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:42330
chemicalCompound:activity
activity:633994
,
activity:2572877