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Sources
3402
Source:
http://linkedlifedata.com/resource/chembl/compound/3402
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Subject
Predicate
Object
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(
33
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:3402
chemicalCompound:standardIn...
InChI=1S/C18H21N3O/c1-20-10-15(14-4-2-3-5-16(14)20)17-19-11-18(22-17)12-21-8-6-13(18)7-9-21/h2-5,10,13H,6-9,11-12H2,1H3
lld:chembl
chemicalCompound:3402
chemicalCompound:standardIn...
GJZYDYYJSGXPCE-UHFFFAOYSA-N
lld:chembl
chemicalCompound:3402
chemicalCompound:canonicalS...
Cn1cc(C2=NCC3(CN4CCC3CC4)O2)c5ccccc15
lld:chembl
chemicalCompound:3402
chemicalCompound:molecularF...
C18 H21 N3 O
lld:chembl
chemicalCompound:3402
chemicalCompound:moleculeId
3402
lld:chembl
chemicalCompound:3402
chemicalCompound:mwFreebase
295.379
lld:chembl
chemicalCompound:3402
chemicalCompound:alogp
2.656
lld:chembl
chemicalCompound:3402
chemicalCompound:hba
3
lld:chembl
chemicalCompound:3402
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:3402
chemicalCompound:psa
29.76
lld:chembl
chemicalCompound:3402
chemicalCompound:rtb
1
lld:chembl
chemicalCompound:3402
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:3402
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:3402
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:3402
chemicalCompound:acdLogP
2.486
lld:chembl
chemicalCompound:3402
chemicalCompound:acdLogD
-0.489
lld:chembl
chemicalCompound:3402
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:3402
chemicalCompound:fullMwt
295.379
lld:chembl
chemicalCompound:3402
chemicalCompound:acdMostBpk...
11.287
lld:chembl
chemicalCompound:3402
chemicalCompound:chemblId
CHEMBL269161
lld:chembl
chemicalCompound:3402
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:3402
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:3402
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:3402
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:3402
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:3402
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:3402
chemicalCompound:oral
No
lld:chembl
chemicalCompound:3402
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:3402
chemicalCompound:topical
No
lld:chembl
chemicalCompound:3402
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:3402
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:3402
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:651797
chemicalCompound:parent
chemicalCompound:3402
lld:chembl