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47885
Source:
http://linkedlifedata.com/resource/chembl/compound/47885
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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:47885
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:47885
chemicalCompound:standardIn...
InChI=1S/C27H36O4S2/c28-25(29)17-19-32-27(33-20-18-26(30)31)24-16-10-15-23(21-24)14-7-4-2-1-3-6-11-22-12-8-5-9-13-22/h5,8-10,12-13,15-16,21,27H,1-4,6-7,11,14,17-20H2,(H,28,29)(H,30,31)
lld:chembl
chemicalCompound:47885
chemicalCompound:standardIn...
ZEWCLTWIGFQTFS-UHFFFAOYSA-N
lld:chembl
chemicalCompound:47885
chemicalCompound:canonicalS...
OC(=O)CCSC(SCCC(=O)O)c1cccc(CCCCCCCCc2ccccc2)c1
lld:chembl
chemicalCompound:47885
chemicalCompound:molecularF...
C27 H36 O4 S2
lld:chembl
chemicalCompound:47885
chemicalCompound:moleculeId
47885
lld:chembl
chemicalCompound:47885
chemicalCompound:mwFreebase
488.702
lld:chembl
chemicalCompound:47885
chemicalCompound:alogp
7.819
lld:chembl
chemicalCompound:47885
chemicalCompound:hba
6
lld:chembl
chemicalCompound:47885
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:47885
chemicalCompound:psa
125.2
lld:chembl
chemicalCompound:47885
chemicalCompound:rtb
18
lld:chembl
chemicalCompound:47885
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:47885
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:47885
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:47885
chemicalCompound:acdMostApk...
3.974
lld:chembl
chemicalCompound:47885
chemicalCompound:acdLogP
7.58
lld:chembl
chemicalCompound:47885
chemicalCompound:acdLogD
2.849
lld:chembl
chemicalCompound:47885
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:47885
chemicalCompound:fullMwt
488.702
lld:chembl
chemicalCompound:47885
chemicalCompound:chemblId
CHEMBL418049
lld:chembl
chemicalCompound:47885
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:47885
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:47885
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:47885
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:47885
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:47885
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:47885
chemicalCompound:oral
No
lld:chembl
chemicalCompound:47885
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:47885
chemicalCompound:topical
No
lld:chembl
chemicalCompound:47885
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:47885
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:47885
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:47885
chemicalCompound:activity
activity:766507
lld:chembl
chemicalCompound:47885
chemicalCompound:activity
activity:766508
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:47885
lld:chembl