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56576
Source:
http://linkedlifedata.com/resource/chembl/compound/56576
Search
Subject
Predicate
Object
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(
44
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:56576
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:56576
chemicalCompound:standardIn...
InChI=1S/C12H13N3O2/c1-15(2)9-5-3-8(4-6-9)7-10-11(16)14-12(17)13-10/h3-7H,1-2H3,(H2,13,14,16,17)/b10-7-
lld:chembl
chemicalCompound:56576
chemicalCompound:standardIn...
KLVRHZIOWMWJOC-YFHOEESVSA-N
lld:chembl
chemicalCompound:56576
chemicalCompound:canonicalS...
CN(C)c1ccc(\C=C\2/NC(=O)NC2=O)cc1
lld:chembl
chemicalCompound:56576
chemicalCompound:molecularF...
C12H13N3O2
lld:chembl
chemicalCompound:56576
chemicalCompound:moleculeId
56576
lld:chembl
chemicalCompound:56576
chemicalCompound:mwFreebase
231.251
lld:chembl
chemicalCompound:56576
chemicalCompound:alogp
0.899
lld:chembl
chemicalCompound:56576
chemicalCompound:hba
3
lld:chembl
chemicalCompound:56576
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:56576
chemicalCompound:psa
61.44
lld:chembl
chemicalCompound:56576
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:56576
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:56576
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:56576
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:56576
chemicalCompound:acdMostApk...
9.137
lld:chembl
chemicalCompound:56576
chemicalCompound:acdLogP
0.915
lld:chembl
chemicalCompound:56576
chemicalCompound:acdLogD
0.914
lld:chembl
chemicalCompound:56576
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:56576
chemicalCompound:fullMwt
231.251
lld:chembl
chemicalCompound:56576
chemicalCompound:acdMostBpk...
3.156
lld:chembl
chemicalCompound:56576
chemicalCompound:chemblId
CHEMBL287938
lld:chembl
chemicalCompound:56576
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:56576
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:56576
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:56576
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:56576
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:56576
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:56576
chemicalCompound:oral
No
lld:chembl
chemicalCompound:56576
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:56576
chemicalCompound:topical
No
lld:chembl
chemicalCompound:56576
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:56576
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:56576
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:615819
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:615820
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:2992784
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:8053314
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:8054106
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:8054269
lld:chembl
chemicalCompound:56576
chemicalCompound:activity
activity:8055004
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:56576
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:56576
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:56576
lld:chembl