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498702
Source:
http://linkedlifedata.com/resource/chembl/compound/498702
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Subject
Predicate
Object
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(
38
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:498702
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:498702
chemicalCompound:standardIn...
InChI=1S/C23H20N4O4S/c1-31-18-6-4-16(5-7-18)15-27-21-9-8-19(32(29,30)26-10-2-3-11-26)12-20(21)22(23(27)28)17(13-24)14-25/h4-9,12H,2-3,10-11,15H2,1H3
lld:chembl
chemicalCompound:498702
chemicalCompound:standardIn...
NTYVQLJOENRPJL-UHFFFAOYSA-N
lld:chembl
chemicalCompound:498702
chemicalCompound:canonicalS...
COc1ccc(CN2C(=O)C(=C(C#N)C#N)c3cc(ccc23)S(=O)(=O)N4CCCC4)cc1
lld:chembl
chemicalCompound:498702
chemicalCompound:molecularF...
C23H20N4O4S
lld:chembl
chemicalCompound:498702
chemicalCompound:moleculeId
498702
lld:chembl
chemicalCompound:498702
chemicalCompound:mwFreebase
448.494
lld:chembl
chemicalCompound:498702
chemicalCompound:alogp
2.281
lld:chembl
chemicalCompound:498702
chemicalCompound:hba
6
lld:chembl
chemicalCompound:498702
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:498702
chemicalCompound:psa
122.88
lld:chembl
chemicalCompound:498702
chemicalCompound:rtb
5
lld:chembl
chemicalCompound:498702
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:498702
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:498702
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:498702
chemicalCompound:acdLogP
3.349
lld:chembl
chemicalCompound:498702
chemicalCompound:acdLogD
3.349
lld:chembl
chemicalCompound:498702
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:498702
chemicalCompound:fullMwt
448.494
lld:chembl
chemicalCompound:498702
chemicalCompound:chemblId
CHEMBL477659
lld:chembl
chemicalCompound:498702
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:498702
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:498702
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:498702
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:498702
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:498702
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:498702
chemicalCompound:oral
No
lld:chembl
chemicalCompound:498702
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:498702
chemicalCompound:topical
No
lld:chembl
chemicalCompound:498702
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:498702
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:498702
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:498702
chemicalCompound:activity
activity:2402481
lld:chembl
chemicalCompound:498702
chemicalCompound:activity
activity:2402484
lld:chembl
chemicalCompound:498702
chemicalCompound:activity
activity:2402496
lld:chembl
chemicalCompound:498702
chemicalCompound:activity
activity:2402524
lld:chembl
chemicalCompound:498702
chemicalCompound:activity
activity:2402561
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:498702
lld:chembl