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47959
Source:
http://linkedlifedata.com/resource/chembl/compound/47959
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Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:47959
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:47959
chemicalCompound:standardIn...
InChI=1S/C21H32O4S2/c1-2-3-4-5-6-7-10-17-11-8-9-12-18(17)21(26-15-13-19(22)23)27-16-14-20(24)25/h8-9,11-12,21H,2-7,10,13-16H2,1H3,(H,22,23)(H,24,25)
lld:chembl
chemicalCompound:47959
chemicalCompound:standardIn...
FDEILESHCBSGDV-UHFFFAOYSA-N
lld:chembl
chemicalCompound:47959
chemicalCompound:canonicalS...
CCCCCCCCc1ccccc1C(SCCC(=O)O)SCCC(=O)O
lld:chembl
chemicalCompound:47959
chemicalCompound:molecularF...
C21 H32 O4 S2
lld:chembl
chemicalCompound:47959
chemicalCompound:moleculeId
47959
lld:chembl
chemicalCompound:47959
chemicalCompound:mwFreebase
412.606
lld:chembl
chemicalCompound:47959
chemicalCompound:alogp
6.331
lld:chembl
chemicalCompound:47959
chemicalCompound:hba
6
lld:chembl
chemicalCompound:47959
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:47959
chemicalCompound:psa
125.2
lld:chembl
chemicalCompound:47959
chemicalCompound:rtb
16
lld:chembl
chemicalCompound:47959
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:47959
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:47959
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:47959
chemicalCompound:acdMostApk...
3.974
lld:chembl
chemicalCompound:47959
chemicalCompound:acdLogP
5.784
lld:chembl
chemicalCompound:47959
chemicalCompound:acdLogD
1.053
lld:chembl
chemicalCompound:47959
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:47959
chemicalCompound:fullMwt
412.606
lld:chembl
chemicalCompound:47959
chemicalCompound:chemblId
CHEMBL33254
lld:chembl
chemicalCompound:47959
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:47959
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:47959
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:47959
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:47959
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:47959
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:47959
chemicalCompound:oral
No
lld:chembl
chemicalCompound:47959
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:47959
chemicalCompound:topical
No
lld:chembl
chemicalCompound:47959
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:47959
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:47959
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:47959
chemicalCompound:activity
activity:753467
lld:chembl
chemicalCompound:47959
chemicalCompound:activity
activity:753468
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:47959
lld:chembl