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Sources
513137
Source:
http://linkedlifedata.com/resource/chembl/compound/513137
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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:513137
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:513137
chemicalCompound:standardIn...
InChI=1S/C12H19N3O/c1-9(13)12(16)15-8-11(14)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8,13-14H2,1H3,(H,15,16)/t9-,11+/m0/s1
lld:chembl
chemicalCompound:513137
chemicalCompound:standardIn...
UOIHWOBJIFVAIQ-GXSJLCMTSA-N
lld:chembl
chemicalCompound:513137
chemicalCompound:canonicalS...
C[C@H](N)C(=O)NC[C@H](N)Cc1ccccc1
lld:chembl
chemicalCompound:513137
chemicalCompound:molecularF...
C12H19N3O
lld:chembl
chemicalCompound:513137
chemicalCompound:moleculeId
513137
lld:chembl
chemicalCompound:513137
chemicalCompound:mwFreebase
221.299
lld:chembl
chemicalCompound:513137
chemicalCompound:alogp
0
lld:chembl
chemicalCompound:513137
chemicalCompound:hba
3
lld:chembl
chemicalCompound:513137
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:513137
chemicalCompound:psa
81.14
lld:chembl
chemicalCompound:513137
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:513137
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:513137
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:513137
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:513137
chemicalCompound:acdLogP
-1.172
lld:chembl
chemicalCompound:513137
chemicalCompound:acdLogD
-2.441
lld:chembl
chemicalCompound:513137
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:513137
chemicalCompound:fullMwt
221.299
lld:chembl
chemicalCompound:513137
chemicalCompound:acdMostBpk...
8.267
lld:chembl
chemicalCompound:513137
chemicalCompound:chemblId
CHEMBL457657
lld:chembl
chemicalCompound:513137
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:513137
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:513137
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:513137
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:513137
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:513137
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:513137
chemicalCompound:oral
No
lld:chembl
chemicalCompound:513137
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:513137
chemicalCompound:topical
No
lld:chembl
chemicalCompound:513137
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:513137
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:513137
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:513137
chemicalCompound:activity
activity:2477641
lld:chembl
chemicalCompound:513137
chemicalCompound:activity
activity:2477642
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:513137
lld:chembl