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468627
Source:
http://linkedlifedata.com/resource/chembl/compound/468627
Search
Subject
Predicate
Object
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(
41
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:468627
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:468627
chemicalCompound:standardIn...
InChI=1S/C13H18N4O3/c1-16-10-3-2-8(4-9(10)14-15-16)5-17-6-12(19)13(20)11(17)7-18/h2-4,11-13,18-20H,5-7H2,1H3/t11-,12+,13-/m1/s1
lld:chembl
chemicalCompound:468627
chemicalCompound:standardIn...
QHUJBBNLFXQUGS-FRRDWIJNSA-N
lld:chembl
chemicalCompound:468627
chemicalCompound:canonicalS...
Cn1nnc2cc(CN3C[C@H](O)[C@H](O)[C@H]3CO)ccc12
lld:chembl
chemicalCompound:468627
chemicalCompound:molecularF...
C13H18N4O3
lld:chembl
chemicalCompound:468627
chemicalCompound:moleculeId
468627
lld:chembl
chemicalCompound:468627
chemicalCompound:mwFreebase
278.307
lld:chembl
chemicalCompound:468627
chemicalCompound:alogp
0
lld:chembl
chemicalCompound:468627
chemicalCompound:hba
6
lld:chembl
chemicalCompound:468627
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:468627
chemicalCompound:psa
94.64
lld:chembl
chemicalCompound:468627
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:468627
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:468627
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:468627
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:468627
chemicalCompound:acdLogP
-0.264
lld:chembl
chemicalCompound:468627
chemicalCompound:acdLogD
-0.342
lld:chembl
chemicalCompound:468627
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:468627
chemicalCompound:fullMwt
278.307
lld:chembl
chemicalCompound:468627
chemicalCompound:acdMostBpk...
6.417
lld:chembl
chemicalCompound:468627
chemicalCompound:chemblId
CHEMBL521681
lld:chembl
chemicalCompound:468627
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:468627
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:468627
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:468627
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:468627
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:468627
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:468627
chemicalCompound:oral
No
lld:chembl
chemicalCompound:468627
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:468627
chemicalCompound:topical
No
lld:chembl
chemicalCompound:468627
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:468627
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:468627
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:2452911
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:3485469
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:3485558
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:3485622
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:3487543
lld:chembl
chemicalCompound:468627
chemicalCompound:activity
activity:3487598
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:468627
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:468627
lld:chembl