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782546
Source:
http://linkedlifedata.com/resource/chembl/compound/782546
Search
Subject
Predicate
Object
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(
68
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:782546
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:782546
chemicalCompound:parent
chemicalCompound:10099
lld:chembl
chemicalCompound:782546
chemicalCompound:standardIn...
InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H/t14-;/m1./s1
lld:chembl
chemicalCompound:782546
chemicalCompound:standardIn...
ZMRUPTIKESYGQW-PFEQFJNWSA-N
lld:chembl
chemicalCompound:782546
chemicalCompound:canonicalS...
Cl.CC(C)NC[C@@H](O)COc1cccc2ccccc12
lld:chembl
chemicalCompound:782546
chemicalCompound:molecularF...
C16H22ClNO2
lld:chembl
chemicalCompound:782546
chemicalCompound:moleculeId
782546
lld:chembl
chemicalCompound:782546
chemicalCompound:mwFreebase
259.343
lld:chembl
chemicalCompound:782546
chemicalCompound:alogp
2.54
lld:chembl
chemicalCompound:782546
chemicalCompound:hba
3
lld:chembl
chemicalCompound:782546
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:782546
chemicalCompound:psa
41.48
lld:chembl
chemicalCompound:782546
chemicalCompound:rtb
6
lld:chembl
chemicalCompound:782546
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:782546
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:782546
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:782546
chemicalCompound:acdMostApk...
13.84
lld:chembl
chemicalCompound:782546
chemicalCompound:acdLogP
2.9
lld:chembl
chemicalCompound:782546
chemicalCompound:acdLogD
0.785
lld:chembl
chemicalCompound:782546
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:782546
chemicalCompound:fullMwt
295.804
lld:chembl
chemicalCompound:782546
chemicalCompound:acdMostBpk...
9.5
lld:chembl
chemicalCompound:782546
chemicalCompound:chemblId
CHEMBL1358662
lld:chembl
chemicalCompound:782546
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:782546
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:782546
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:782546
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:782546
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:782546
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:782546
chemicalCompound:oral
No
lld:chembl
chemicalCompound:782546
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:782546
chemicalCompound:topical
No
lld:chembl
chemicalCompound:782546
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:782546
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:782546
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:782546
chemicalCompound:chebiParen...
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3635108
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3655827
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3697298
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3780135
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3951052
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:3975059
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4279582
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4358837
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4403433
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4536352
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4539134
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4683416
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4715495
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4753993
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4844598
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:4974438
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5572031
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5695758
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5760434
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5857506
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5866978
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:5876715
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:6521158
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:7012733
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:7085383
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:7448019
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:7482230
lld:chembl
chemicalCompound:782546
chemicalCompound:activity
activity:7507526
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:782546
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:782546
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:782546
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:782546
lld:chembl