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Sources
544857
Source:
http://linkedlifedata.com/resource/chembl/compound/544857
Search
Subject
Predicate
Object
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(
42
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:544857
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:544857
chemicalCompound:parent
chemicalCompound:5514
lld:chembl
chemicalCompound:544857
chemicalCompound:standardIn...
InChI=1S/C23H26N2O4.ClH/c1-3-11-24(16-14-19-20(28-2)9-6-10-21(19)29-15-16)12-13-25-22(26)17-7-4-5-8-18(17)23(25)27;/h4-10,16H,3,11-15H2,1-2H3;1H
lld:chembl
chemicalCompound:544857
chemicalCompound:standardIn...
JKLZWXDQKZMGDM-UHFFFAOYSA-N
lld:chembl
chemicalCompound:544857
chemicalCompound:canonicalS...
Cl.CCCN(CCN1C(=O)c2ccccc2C1=O)C3COc4cccc(OC)c4C3
lld:chembl
chemicalCompound:544857
chemicalCompound:molecularF...
C23H27ClN2O4
lld:chembl
chemicalCompound:544857
chemicalCompound:moleculeId
544857
lld:chembl
chemicalCompound:544857
chemicalCompound:mwFreebase
394.464
lld:chembl
chemicalCompound:544857
chemicalCompound:alogp
3.592
lld:chembl
chemicalCompound:544857
chemicalCompound:hba
5
lld:chembl
chemicalCompound:544857
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:544857
chemicalCompound:psa
59.08
lld:chembl
chemicalCompound:544857
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:544857
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:544857
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:544857
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:544857
chemicalCompound:acdLogP
3.746
lld:chembl
chemicalCompound:544857
chemicalCompound:acdLogD
2.751
lld:chembl
chemicalCompound:544857
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:544857
chemicalCompound:fullMwt
430.924
lld:chembl
chemicalCompound:544857
chemicalCompound:acdMostBpk...
8.353
lld:chembl
chemicalCompound:544857
chemicalCompound:chemblId
CHEMBL545198
lld:chembl
chemicalCompound:544857
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:544857
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:544857
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:544857
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:544857
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:544857
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:544857
chemicalCompound:oral
No
lld:chembl
chemicalCompound:544857
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:544857
chemicalCompound:topical
No
lld:chembl
chemicalCompound:544857
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:544857
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:544857
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714721
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714722
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714723
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714724
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714725
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714726
lld:chembl
chemicalCompound:544857
chemicalCompound:activity
activity:714727
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:544857
lld:chembl