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656301
Source:
http://linkedlifedata.com/resource/chembl/compound/656301
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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:656301
chemicalCompound:standardIn...
InChI=1S/C16H15F3N6/c17-11-6-13(19)12(18)5-10(11)9-3-4-24(7-14(9)20)16-2-1-15-22-21-8-25(15)23-16/h1-2,5-6,8-9,14H,3-4,7,20H2/t9-,14+/m1/s1
lld:chembl
chemicalCompound:656301
chemicalCompound:standardIn...
IWOOZKGSZIAZCJ-OTYXRUKQSA-N
lld:chembl
chemicalCompound:656301
chemicalCompound:canonicalS...
N[C@H]1CN(CC[C@@H]1c2cc(F)c(F)cc2F)c3ccc4nncn4n3
lld:chembl
chemicalCompound:656301
chemicalCompound:molecularF...
C16H15F3N6
lld:chembl
chemicalCompound:656301
chemicalCompound:moleculeId
656301
lld:chembl
chemicalCompound:656301
chemicalCompound:mwFreebase
348.326
lld:chembl
chemicalCompound:656301
chemicalCompound:alogp
1.868
lld:chembl
chemicalCompound:656301
chemicalCompound:hba
5
lld:chembl
chemicalCompound:656301
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:656301
chemicalCompound:psa
72.34
lld:chembl
chemicalCompound:656301
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:656301
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:656301
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:656301
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:656301
chemicalCompound:acdLogP
1
lld:chembl
chemicalCompound:656301
chemicalCompound:acdLogD
-0.744
lld:chembl
chemicalCompound:656301
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:656301
chemicalCompound:fullMwt
348.326
lld:chembl
chemicalCompound:656301
chemicalCompound:acdMostBpk...
9.243
lld:chembl
chemicalCompound:656301
chemicalCompound:chemblId
CHEMBL1182351
lld:chembl
chemicalCompound:656301
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:656301
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:656301
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:656301
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:656301
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:656301
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:656301
chemicalCompound:oral
No
lld:chembl
chemicalCompound:656301
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:656301
chemicalCompound:topical
No
lld:chembl
chemicalCompound:656301
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:656301
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:656301
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:385318
chemicalCompound:parent
chemicalCompound:656301
lld:chembl