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658171
Source:
http://linkedlifedata.com/resource/chembl/compound/658171
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Subject
Predicate
Object
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(
34
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:658171
chemicalCompound:standardIn...
InChI=1S/C11H12N4/c1-12-7-14-10-4-2-3-9(5-10)11-6-13-8-15-11/h2-8H,1H3,(H,12,14)(H,13,15)
lld:chembl
chemicalCompound:658171
chemicalCompound:standardIn...
ZAEYSAWLARNQTE-UHFFFAOYSA-N
lld:chembl
chemicalCompound:658171
chemicalCompound:canonicalS...
C\N=C\Nc1cccc(c1)c2c[nH]cn2
lld:chembl
chemicalCompound:658171
chemicalCompound:molecularF...
C11H12N4
lld:chembl
chemicalCompound:658171
chemicalCompound:moleculeId
658171
lld:chembl
chemicalCompound:658171
chemicalCompound:mwFreebase
200.24
lld:chembl
chemicalCompound:658171
chemicalCompound:alogp
0.966
lld:chembl
chemicalCompound:658171
chemicalCompound:hba
3
lld:chembl
chemicalCompound:658171
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:658171
chemicalCompound:psa
53.07
lld:chembl
chemicalCompound:658171
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:658171
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:658171
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:658171
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:658171
chemicalCompound:acdMostApk...
13.702
lld:chembl
chemicalCompound:658171
chemicalCompound:acdLogP
1.212
lld:chembl
chemicalCompound:658171
chemicalCompound:acdLogD
0
lld:chembl
chemicalCompound:658171
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:658171
chemicalCompound:fullMwt
200.24
lld:chembl
chemicalCompound:658171
chemicalCompound:acdMostBpk...
8.654
lld:chembl
chemicalCompound:658171
chemicalCompound:chemblId
CHEMBL1184221
lld:chembl
chemicalCompound:658171
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:658171
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:658171
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:658171
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:658171
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:658171
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:658171
chemicalCompound:oral
No
lld:chembl
chemicalCompound:658171
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:658171
chemicalCompound:topical
No
lld:chembl
chemicalCompound:658171
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:658171
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:658171
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:207952
chemicalCompound:parent
chemicalCompound:658171
lld:chembl