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159080
Source:
http://linkedlifedata.com/resource/chembl/compound/159080
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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:159080
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:159080
chemicalCompound:standardIn...
InChI=1S/C14H17Cl2N/c15-10-4-6-12(13(16)9-10)14-7-5-11-3-1-2-8-17(11)14/h4,6,9,11,14H,1-3,5,7-8H2/t11-,14-/m1/s1
lld:chembl
chemicalCompound:159080
chemicalCompound:standardIn...
SPSISAJKNKOSEY-BXUZGUMPSA-N
lld:chembl
chemicalCompound:159080
chemicalCompound:canonicalS...
Clc1ccc([C@H]2CC[C@H]3CCCCN23)c(Cl)c1
lld:chembl
chemicalCompound:159080
chemicalCompound:molecularF...
C14 H17 Cl2 N
lld:chembl
chemicalCompound:159080
chemicalCompound:moleculeId
159080
lld:chembl
chemicalCompound:159080
chemicalCompound:mwFreebase
270.197
lld:chembl
chemicalCompound:159080
chemicalCompound:alogp
4.668
lld:chembl
chemicalCompound:159080
chemicalCompound:hba
1
lld:chembl
chemicalCompound:159080
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:159080
chemicalCompound:psa
3.24
lld:chembl
chemicalCompound:159080
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:159080
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:159080
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:159080
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:159080
chemicalCompound:acdLogP
3.955
lld:chembl
chemicalCompound:159080
chemicalCompound:acdLogD
2.31
lld:chembl
chemicalCompound:159080
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:159080
chemicalCompound:fullMwt
270.197
lld:chembl
chemicalCompound:159080
chemicalCompound:acdMostBpk...
9.05
lld:chembl
chemicalCompound:159080
chemicalCompound:chemblId
CHEMBL97959
lld:chembl
chemicalCompound:159080
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:159080
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:159080
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:159080
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:159080
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:159080
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:159080
chemicalCompound:oral
No
lld:chembl
chemicalCompound:159080
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:159080
chemicalCompound:topical
No
lld:chembl
chemicalCompound:159080
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:159080
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:159080
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:159080
chemicalCompound:activity
activity:62791
lld:chembl
chemicalCompound:159080
chemicalCompound:activity
activity:62792
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:159080
lld:chembl