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801857
Source:
http://linkedlifedata.com/resource/chembl/compound/801857
Search
Subject
Predicate
Object
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(
52
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:801857
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:801857
chemicalCompound:standardIn...
InChI=1S/C16H14BrN5O3/c17-11-9-18-14-8-12(19-22(14)10-11)15(23)20-3-5-21(6-4-20)16(24)13-2-1-7-25-13/h1-2,7-10H,3-6H2
lld:chembl
chemicalCompound:801857
chemicalCompound:standardIn...
JYMATOLOUZWCRG-UHFFFAOYSA-N
lld:chembl
chemicalCompound:801857
chemicalCompound:canonicalS...
Brc1cnc2cc(nn2c1)C(=O)N3CCN(CC3)C(=O)c4occc4
lld:chembl
chemicalCompound:801857
chemicalCompound:molecularF...
C16H14BrN5O3
lld:chembl
chemicalCompound:801857
chemicalCompound:moleculeId
801857
lld:chembl
chemicalCompound:801857
chemicalCompound:mwFreebase
404.218
lld:chembl
chemicalCompound:801857
chemicalCompound:alogp
0.97
lld:chembl
chemicalCompound:801857
chemicalCompound:hba
4
lld:chembl
chemicalCompound:801857
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:801857
chemicalCompound:psa
83.94
lld:chembl
chemicalCompound:801857
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:801857
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:801857
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:801857
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:801857
chemicalCompound:acdLogP
0.871
lld:chembl
chemicalCompound:801857
chemicalCompound:acdLogD
0.871
lld:chembl
chemicalCompound:801857
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:801857
chemicalCompound:fullMwt
404.218
lld:chembl
chemicalCompound:801857
chemicalCompound:chemblId
CHEMBL1377973
lld:chembl
chemicalCompound:801857
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:801857
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:801857
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:801857
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:801857
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:801857
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:801857
chemicalCompound:oral
No
lld:chembl
chemicalCompound:801857
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:801857
chemicalCompound:topical
No
lld:chembl
chemicalCompound:801857
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:801857
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:801857
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:3921717
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:3932869
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4175039
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4248346
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4310090
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4347107
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4419443
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4536665
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:4625278
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5035509
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5376324
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5530962
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5559542
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5631552
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:5825840
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:6522038
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:6908017
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:6959887
lld:chembl
chemicalCompound:801857
chemicalCompound:activity
activity:6974216
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:801857
lld:chembl