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171437
Source:
http://linkedlifedata.com/resource/chembl/compound/171437
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Subject
(
32
)
Predicate
Object
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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/C4H11OS/c1-6(2)4-3-5/h5H,3-4H2,1-2H3/q+1
chemicalCompound:standardIn...
DPYMRUOGINZSQM-UHFFFAOYSA-N
chemicalCompound:canonicalS...
C[S+](C)CCO
chemicalCompound:molecularF...
C4H11OS
chemicalCompound:moleculeId
171437
chemicalCompound:mwFreebase
107.195
chemicalCompound:alogp
0.358
chemicalCompound:hba
1
chemicalCompound:hbd
1
chemicalCompound:psa
22.93
chemicalCompound:rtb
2
chemicalCompound:ro3Pass
Y
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
12.782
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
107.196
chemicalCompound:chemblId
CHEMBL104586
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:271437
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:1238302