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45268
Source:
http://linkedlifedata.com/resource/chembl/compound/45268
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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:45268
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:45268
chemicalCompound:standardIn...
InChI=1S/C28H40N2O3S/c1-5-7-17-29(18-8-6-2)19-11-21-33-25-13-15-26(16-14-25)34(31,32)28-27(23(3)4)22-24-12-9-10-20-30(24)28/h9-10,12-16,20,22-23H,5-8,11,17-19,21H2,1-4H3
lld:chembl
chemicalCompound:45268
chemicalCompound:standardIn...
XVKSCRWGZPSWLD-UHFFFAOYSA-N
lld:chembl
chemicalCompound:45268
chemicalCompound:canonicalS...
CCCCN(CCCC)CCCOc1ccc(cc1)S(=O)(=O)c2c(cc3ccccn23)C(C)C
lld:chembl
chemicalCompound:45268
chemicalCompound:molecularF...
C28 H40 N2 O3 S
lld:chembl
chemicalCompound:45268
chemicalCompound:moleculeId
45268
lld:chembl
chemicalCompound:45268
chemicalCompound:mwFreebase
484.694
lld:chembl
chemicalCompound:45268
chemicalCompound:alogp
7.203
lld:chembl
chemicalCompound:45268
chemicalCompound:hba
4
lld:chembl
chemicalCompound:45268
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:45268
chemicalCompound:psa
59.4
lld:chembl
chemicalCompound:45268
chemicalCompound:rtb
14
lld:chembl
chemicalCompound:45268
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:45268
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:45268
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:45268
chemicalCompound:acdLogP
6.721
lld:chembl
chemicalCompound:45268
chemicalCompound:acdLogD
4.736
lld:chembl
chemicalCompound:45268
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:45268
chemicalCompound:fullMwt
484.694
lld:chembl
chemicalCompound:45268
chemicalCompound:acdMostBpk...
9.415
lld:chembl
chemicalCompound:45268
chemicalCompound:chemblId
CHEMBL30440
lld:chembl
chemicalCompound:45268
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:45268
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:45268
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:45268
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:45268
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:45268
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:45268
chemicalCompound:oral
No
lld:chembl
chemicalCompound:45268
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:45268
chemicalCompound:topical
No
lld:chembl
chemicalCompound:45268
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:45268
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:45268
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:45268
chemicalCompound:activity
activity:277903
lld:chembl
chemicalCompound:45268
chemicalCompound:activity
activity:277904
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:45268
lld:chembl