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677616
Source:
http://linkedlifedata.com/resource/chembl/compound/677616
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:677616
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:677616
chemicalCompound:parent
chemicalCompound:263957
lld:chembl
chemicalCompound:677616
chemicalCompound:standardIn...
InChI=1S/C22H27NO2.ClH/c1-2-8-20(9-3-1)12-13-21-10-4-5-11-22(21)25-17-7-6-14-23-15-18-24-19-16-23;/h1-5,8-13H,6-7,14-19H2;1H/b13-12+;
lld:chembl
chemicalCompound:677616
chemicalCompound:standardIn...
KAYBFSYZRGINRJ-UEIGIMKUSA-N
lld:chembl
chemicalCompound:677616
chemicalCompound:canonicalS...
Cl.C(CCN1CCOCC1)COc2ccccc2\C=C\c3ccccc3
lld:chembl
chemicalCompound:677616
chemicalCompound:molecularF...
C22H28ClNO2
lld:chembl
chemicalCompound:677616
chemicalCompound:moleculeId
677616
lld:chembl
chemicalCompound:677616
chemicalCompound:mwFreebase
337.455
lld:chembl
chemicalCompound:677616
chemicalCompound:alogp
4.268
lld:chembl
chemicalCompound:677616
chemicalCompound:hba
3
lld:chembl
chemicalCompound:677616
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:677616
chemicalCompound:psa
21.7
lld:chembl
chemicalCompound:677616
chemicalCompound:rtb
8
lld:chembl
chemicalCompound:677616
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:677616
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:677616
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:677616
chemicalCompound:acdLogP
3.843
lld:chembl
chemicalCompound:677616
chemicalCompound:acdLogD
3.529
lld:chembl
chemicalCompound:677616
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:677616
chemicalCompound:fullMwt
373.916
lld:chembl
chemicalCompound:677616
chemicalCompound:acdMostBpk...
7.427
lld:chembl
chemicalCompound:677616
chemicalCompound:chemblId
CHEMBL1203665
lld:chembl
chemicalCompound:677616
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:677616
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:677616
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:677616
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:677616
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:677616
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:677616
chemicalCompound:oral
No
lld:chembl
chemicalCompound:677616
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:677616
chemicalCompound:topical
No
lld:chembl
chemicalCompound:677616
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:677616
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:677616
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:677616
chemicalCompound:activity
activity:1297789
lld:chembl
chemicalCompound:677616
chemicalCompound:activity
activity:1297790
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:677616
lld:chembl