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1057510
Source:
http://linkedlifedata.com/resource/chembl/compound/1057510
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:1057510
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1057510
chemicalCompound:standardIn...
InChI=1S/C12H8Br2N2O/c13-9-1-3-11(4-2-9)16-12(17)8-5-10(14)7-15-6-8/h1-7H,(H,16,17)
lld:chembl
chemicalCompound:1057510
chemicalCompound:standardIn...
IKEYGBNIAAQOQM-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1057510
chemicalCompound:canonicalS...
Brc1ccc(NC(=O)c2cncc(Br)c2)cc1
lld:chembl
chemicalCompound:1057510
chemicalCompound:molecularF...
C12H8Br2N2O
lld:chembl
chemicalCompound:1057510
chemicalCompound:moleculeId
1057510
lld:chembl
chemicalCompound:1057510
chemicalCompound:mwFreebase
356.013
lld:chembl
chemicalCompound:1057510
chemicalCompound:alogp
2.96
lld:chembl
chemicalCompound:1057510
chemicalCompound:hba
2
lld:chembl
chemicalCompound:1057510
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:1057510
chemicalCompound:psa
41.99
lld:chembl
chemicalCompound:1057510
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:1057510
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1057510
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1057510
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1057510
chemicalCompound:acdMostApk...
10.696
lld:chembl
chemicalCompound:1057510
chemicalCompound:acdLogP
3.426
lld:chembl
chemicalCompound:1057510
chemicalCompound:acdLogD
3.426
lld:chembl
chemicalCompound:1057510
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:1057510
chemicalCompound:fullMwt
356.013
lld:chembl
chemicalCompound:1057510
chemicalCompound:acdMostBpk...
1
lld:chembl
chemicalCompound:1057510
chemicalCompound:chemblId
CHEMBL1643009
lld:chembl
chemicalCompound:1057510
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1057510
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1057510
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1057510
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1057510
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1057510
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1057510
chemicalCompound:activity
activity:5120541
lld:chembl
chemicalCompound:1057510
chemicalCompound:activity
activity:5120582
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1057510
lld:chembl