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230050
Source:
http://linkedlifedata.com/resource/chembl/compound/230050
Search
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:230050
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:230050
chemicalCompound:standardIn...
InChI=1S/C14H16N2O/c1-16-9-5-8-13(16)14-10-12(15-17-14)11-6-3-2-4-7-11/h2-4,6-7,10,13H,5,8-9H2,1H3/t13-/m1/s1
lld:chembl
chemicalCompound:230050
chemicalCompound:standardIn...
NONKIUWFSVQOOU-CYBMUJFWSA-N
lld:chembl
chemicalCompound:230050
chemicalCompound:canonicalS...
CN1CCC[C@@H]1c2onc(c2)c3ccccc3
lld:chembl
chemicalCompound:230050
chemicalCompound:molecularF...
C14 H16 N2 O
lld:chembl
chemicalCompound:230050
chemicalCompound:moleculeId
230050
lld:chembl
chemicalCompound:230050
chemicalCompound:mwFreebase
228.29
lld:chembl
chemicalCompound:230050
chemicalCompound:alogp
2.978
lld:chembl
chemicalCompound:230050
chemicalCompound:hba
2
lld:chembl
chemicalCompound:230050
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:230050
chemicalCompound:psa
29.27
lld:chembl
chemicalCompound:230050
chemicalCompound:rtb
2
lld:chembl
chemicalCompound:230050
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:230050
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:230050
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:230050
chemicalCompound:acdLogP
3.118
lld:chembl
chemicalCompound:230050
chemicalCompound:acdLogD
1.708
lld:chembl
chemicalCompound:230050
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:230050
chemicalCompound:fullMwt
228.29
lld:chembl
chemicalCompound:230050
chemicalCompound:acdMostBpk...
8.802
lld:chembl
chemicalCompound:230050
chemicalCompound:chemblId
CHEMBL139502
lld:chembl
chemicalCompound:230050
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:230050
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:230050
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:230050
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:230050
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:230050
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:230050
chemicalCompound:oral
No
lld:chembl
chemicalCompound:230050
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:230050
chemicalCompound:topical
No
lld:chembl
chemicalCompound:230050
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:230050
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:230050
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:230050
chemicalCompound:activity
activity:228269
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:230050
lld:chembl