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485631
Source:
http://linkedlifedata.com/resource/chembl/compound/485631
Search
Subject
Predicate
Object
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(
41
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:485631
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:485631
chemicalCompound:standardIn...
InChI=1S/C17H18N2O9/c20-9-11(21)14-13(22)15(17(23)27-14)25-7-4-8-26-16-12(19(24)28-18-16)10-5-2-1-3-6-10/h1-3,5-6,11,14,20-22H,4,7-9H2
lld:chembl
chemicalCompound:485631
chemicalCompound:standardIn...
ZNFDKNPZVLDKPJ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:485631
chemicalCompound:canonicalS...
OCC(O)C1OC(=O)C(=C1O)OCCCOc2no[n+]([O-])c2c3ccccc3
lld:chembl
chemicalCompound:485631
chemicalCompound:molecularF...
C17H18N2O9
lld:chembl
chemicalCompound:485631
chemicalCompound:moleculeId
485631
lld:chembl
chemicalCompound:485631
chemicalCompound:mwFreebase
394.333
lld:chembl
chemicalCompound:485631
chemicalCompound:alogp
-2.189
lld:chembl
chemicalCompound:485631
chemicalCompound:hba
9
lld:chembl
chemicalCompound:485631
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:485631
chemicalCompound:psa
156.94
lld:chembl
chemicalCompound:485631
chemicalCompound:rtb
9
lld:chembl
chemicalCompound:485631
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:485631
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:485631
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:485631
chemicalCompound:acdMostApk...
3.646
lld:chembl
chemicalCompound:485631
chemicalCompound:acdLogP
0.28
lld:chembl
chemicalCompound:485631
chemicalCompound:acdLogD
-2.937
lld:chembl
chemicalCompound:485631
chemicalCompound:molecularS...
molecularSpecies:ACID
lld:chembl
chemicalCompound:485631
chemicalCompound:fullMwt
394.333
lld:chembl
chemicalCompound:485631
chemicalCompound:acdMostBpk...
2.883
lld:chembl
chemicalCompound:485631
chemicalCompound:chemblId
CHEMBL494607
lld:chembl
chemicalCompound:485631
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:485631
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:485631
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:485631
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:485631
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:485631
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:485631
chemicalCompound:oral
No
lld:chembl
chemicalCompound:485631
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:485631
chemicalCompound:topical
No
lld:chembl
chemicalCompound:485631
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:485631
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:485631
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187626
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187634
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187642
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187649
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187659
lld:chembl
chemicalCompound:485631
chemicalCompound:activity
activity:2187670
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:485631
lld:chembl