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887976
Source:
http://linkedlifedata.com/resource/chembl/compound/887976
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Subject
Predicate
Object
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(
39
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:887976
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:887976
chemicalCompound:parent
chemicalCompound:507189
lld:chembl
chemicalCompound:887976
chemicalCompound:standardIn...
InChI=1S/C13H16N2.ClH/c1-9-3-4-12-10(7-9)11-8-15(2)6-5-13(11)14-12;/h3-4,7,14H,5-6,8H2,1-2H3;1H
lld:chembl
chemicalCompound:887976
chemicalCompound:standardIn...
PFONODSJWIPQRB-UHFFFAOYSA-N
lld:chembl
chemicalCompound:887976
chemicalCompound:canonicalS...
Cl.CN1CCc2[nH]c3ccc(C)cc3c2C1
lld:chembl
chemicalCompound:887976
chemicalCompound:molecularF...
C13H17ClN2
lld:chembl
chemicalCompound:887976
chemicalCompound:moleculeId
887976
lld:chembl
chemicalCompound:887976
chemicalCompound:mwFreebase
200.28
lld:chembl
chemicalCompound:887976
chemicalCompound:alogp
2.763
lld:chembl
chemicalCompound:887976
chemicalCompound:hba
1
lld:chembl
chemicalCompound:887976
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:887976
chemicalCompound:psa
19.03
lld:chembl
chemicalCompound:887976
chemicalCompound:rtb
0
lld:chembl
chemicalCompound:887976
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:887976
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:887976
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:887976
chemicalCompound:acdLogP
1.613
lld:chembl
chemicalCompound:887976
chemicalCompound:acdLogD
0.097
lld:chembl
chemicalCompound:887976
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:887976
chemicalCompound:fullMwt
236.74
lld:chembl
chemicalCompound:887976
chemicalCompound:acdMostBpk...
9.019
lld:chembl
chemicalCompound:887976
chemicalCompound:chemblId
CHEMBL1464092
lld:chembl
chemicalCompound:887976
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:887976
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:887976
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:887976
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:887976
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:887976
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:887976
chemicalCompound:oral
No
lld:chembl
chemicalCompound:887976
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:887976
chemicalCompound:topical
No
lld:chembl
chemicalCompound:887976
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:887976
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:887976
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:887976
chemicalCompound:activity
activity:4354109
lld:chembl
chemicalCompound:887976
chemicalCompound:activity
activity:4623107
lld:chembl
chemicalCompound:887976
chemicalCompound:activity
activity:4828744
lld:chembl
chemicalCompound:887976
chemicalCompound:activity
activity:5845837
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:887976
lld:chembl