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962338
Source:
http://linkedlifedata.com/resource/chembl/compound/962338
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Subject
Predicate
Object
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(
39
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:962338
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:962338
chemicalCompound:standardIn...
InChI=1S/C16H12N2O4/c19-15(13-3-1-9-21-13)17-11-5-7-12(8-6-11)18-16(20)14-4-2-10-22-14/h1-10H,(H,17,19)(H,18,20)
lld:chembl
chemicalCompound:962338
chemicalCompound:standardIn...
VYTSTYVCKSFCPZ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:962338
chemicalCompound:canonicalS...
O=C(Nc1ccc(NC(=O)c2occc2)cc1)c3occc3
lld:chembl
chemicalCompound:962338
chemicalCompound:molecularF...
C16H12N2O4
lld:chembl
chemicalCompound:962338
chemicalCompound:moleculeId
962338
lld:chembl
chemicalCompound:962338
chemicalCompound:mwFreebase
296.277
lld:chembl
chemicalCompound:962338
chemicalCompound:alogp
2.189
lld:chembl
chemicalCompound:962338
chemicalCompound:hba
2
lld:chembl
chemicalCompound:962338
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:962338
chemicalCompound:psa
84.48
lld:chembl
chemicalCompound:962338
chemicalCompound:rtb
4
lld:chembl
chemicalCompound:962338
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:962338
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:962338
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:962338
chemicalCompound:acdMostApk...
12.053
lld:chembl
chemicalCompound:962338
chemicalCompound:acdLogP
0.288
lld:chembl
chemicalCompound:962338
chemicalCompound:acdLogD
0.288
lld:chembl
chemicalCompound:962338
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:962338
chemicalCompound:fullMwt
296.277
lld:chembl
chemicalCompound:962338
chemicalCompound:acdMostBpk...
0.951
lld:chembl
chemicalCompound:962338
chemicalCompound:chemblId
CHEMBL1538454
lld:chembl
chemicalCompound:962338
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:962338
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:962338
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:962338
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:962338
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:962338
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:962338
chemicalCompound:oral
No
lld:chembl
chemicalCompound:962338
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:962338
chemicalCompound:topical
No
lld:chembl
chemicalCompound:962338
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:962338
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:962338
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:962338
chemicalCompound:activity
activity:5330945
lld:chembl
chemicalCompound:962338
chemicalCompound:activity
activity:5757253
lld:chembl
chemicalCompound:962338
chemicalCompound:activity
activity:6510591
lld:chembl
chemicalCompound:962338
chemicalCompound:activity
activity:6651174
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:962338
lld:chembl