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986168
Source:
http://linkedlifedata.com/resource/chembl/compound/986168
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Subject
Predicate
Object
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(
35
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:986168
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:986168
chemicalCompound:standardIn...
InChI=1S/C19H16BrNO5/c1-10(22)16-17(11-3-8-14(23)15(9-11)26-2)21(19(25)18(16)24)13-6-4-12(20)5-7-13/h3-9,17,23-24H,1-2H3
lld:chembl
chemicalCompound:986168
chemicalCompound:standardIn...
SIKVHNWRWQWVEE-UHFFFAOYSA-N
lld:chembl
chemicalCompound:986168
chemicalCompound:canonicalS...
COc1cc(ccc1O)C2N(C(=O)C(=C2C(=O)C)O)c3ccc(Br)cc3
lld:chembl
chemicalCompound:986168
chemicalCompound:molecularF...
C19H16BrNO5
lld:chembl
chemicalCompound:986168
chemicalCompound:moleculeId
986168
lld:chembl
chemicalCompound:986168
chemicalCompound:mwFreebase
418.238
lld:chembl
chemicalCompound:986168
chemicalCompound:alogp
2.778
lld:chembl
chemicalCompound:986168
chemicalCompound:hba
5
lld:chembl
chemicalCompound:986168
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:986168
chemicalCompound:psa
87.07
lld:chembl
chemicalCompound:986168
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:986168
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:986168
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:986168
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:986168
chemicalCompound:acdMostApk...
4.5
lld:chembl
chemicalCompound:986168
chemicalCompound:acdLogP
2.806
lld:chembl
chemicalCompound:986168
chemicalCompound:acdLogD
0
lld:chembl
chemicalCompound:986168
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:986168
chemicalCompound:fullMwt
418.238
lld:chembl
chemicalCompound:986168
chemicalCompound:chemblId
CHEMBL1562284
lld:chembl
chemicalCompound:986168
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:986168
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:986168
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:986168
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:986168
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:986168
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:986168
chemicalCompound:oral
No
lld:chembl
chemicalCompound:986168
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:986168
chemicalCompound:topical
No
lld:chembl
chemicalCompound:986168
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:986168
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:986168
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:986168
chemicalCompound:activity
activity:4839302
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:986168
lld:chembl