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1062540
Source:
http://linkedlifedata.com/resource/chembl/compound/1062540
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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:1062540
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1062540
chemicalCompound:standardIn...
InChI=1S/C12H12N2O2/c15-7-9-1-3-13-11(5-9)12-6-10(8-16)2-4-14-12/h1-6,15-16H,7-8H2
lld:chembl
chemicalCompound:1062540
chemicalCompound:standardIn...
RRXGRDMHWYLJSY-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1062540
chemicalCompound:canonicalS...
OCc1ccnc(c1)c2cc(CO)ccn2
lld:chembl
chemicalCompound:1062540
chemicalCompound:molecularF...
C12H12N2O2
lld:chembl
chemicalCompound:1062540
chemicalCompound:moleculeId
1062540
lld:chembl
chemicalCompound:1062540
chemicalCompound:mwFreebase
216.236
lld:chembl
chemicalCompound:1062540
chemicalCompound:alogp
0.695
lld:chembl
chemicalCompound:1062540
chemicalCompound:hba
4
lld:chembl
chemicalCompound:1062540
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:1062540
chemicalCompound:psa
66.24
lld:chembl
chemicalCompound:1062540
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:1062540
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1062540
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1062540
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1062540
chemicalCompound:acdMostApk...
12.945
lld:chembl
chemicalCompound:1062540
chemicalCompound:acdLogP
-0.11
lld:chembl
chemicalCompound:1062540
chemicalCompound:acdLogD
-0.11
lld:chembl
chemicalCompound:1062540
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:1062540
chemicalCompound:fullMwt
216.236
lld:chembl
chemicalCompound:1062540
chemicalCompound:acdMostBpk...
4.101
lld:chembl
chemicalCompound:1062540
chemicalCompound:chemblId
CHEMBL1650629
lld:chembl
chemicalCompound:1062540
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1062540
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1062540
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1062540
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1062540
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1062540
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5193081
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5193498
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5193541
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5193737
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5194088
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5194110
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5194296
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5194399
lld:chembl
chemicalCompound:1062540
chemicalCompound:activity
activity:5194428
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1062540
lld:chembl