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87114
Source:
http://linkedlifedata.com/resource/chembl/compound/87114
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Subject
Predicate
Object
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(
38
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:87114
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:87114
chemicalCompound:standardIn...
InChI=1S/C29H34N2O2/c32-26-12-16-29-25(21-26)11-15-28(24-7-3-1-4-8-24)31(29)22-23-9-13-27(14-10-23)33-20-19-30-17-5-2-6-18-30/h1,3-4,7-10,12-14,16,21,28,32H,2,5-6,11,15,17-20,22H2
lld:chembl
chemicalCompound:87114
chemicalCompound:standardIn...
OQJYJENHHOZHPV-UHFFFAOYSA-N
lld:chembl
chemicalCompound:87114
chemicalCompound:canonicalS...
Oc1ccc2N(Cc3ccc(OCCN4CCCCC4)cc3)C(CCc2c1)c5ccccc5
lld:chembl
chemicalCompound:87114
chemicalCompound:molecularF...
C29 H34 N2 O2
lld:chembl
chemicalCompound:87114
chemicalCompound:moleculeId
87114
lld:chembl
chemicalCompound:87114
chemicalCompound:mwFreebase
442.592
lld:chembl
chemicalCompound:87114
chemicalCompound:alogp
6.516
lld:chembl
chemicalCompound:87114
chemicalCompound:hba
4
lld:chembl
chemicalCompound:87114
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:87114
chemicalCompound:psa
35.94
lld:chembl
chemicalCompound:87114
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:87114
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:87114
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:87114
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:87114
chemicalCompound:acdMostApk...
10.419
lld:chembl
chemicalCompound:87114
chemicalCompound:acdLogP
4.903
lld:chembl
chemicalCompound:87114
chemicalCompound:acdLogD
3.624
lld:chembl
chemicalCompound:87114
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:87114
chemicalCompound:fullMwt
442.592
lld:chembl
chemicalCompound:87114
chemicalCompound:acdMostBpk...
8.648
lld:chembl
chemicalCompound:87114
chemicalCompound:chemblId
CHEMBL60538
lld:chembl
chemicalCompound:87114
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:87114
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:87114
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:87114
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:87114
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:87114
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:87114
chemicalCompound:oral
No
lld:chembl
chemicalCompound:87114
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:87114
chemicalCompound:topical
No
lld:chembl
chemicalCompound:87114
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:87114
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:87114
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:87114
chemicalCompound:activity
activity:147372
lld:chembl
chemicalCompound:87114
chemicalCompound:activity
activity:147373
lld:chembl
chemicalCompound:87114
chemicalCompound:activity
activity:147374
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:87114
lld:chembl