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1078466
Source:
http://linkedlifedata.com/resource/chembl/compound/1078466
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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:1078466
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1078466
chemicalCompound:parent
chemicalCompound:130007
lld:chembl
chemicalCompound:1078466
chemicalCompound:standardIn...
InChI=1S/2C9H7NO.H2O4S/c2*11-8-5-1-3-7-4-2-6-10-9(7)8;1-5(2,3)4/h2*1-6,11H;(H2,1,2,3,4)
lld:chembl
chemicalCompound:1078466
chemicalCompound:standardIn...
YYVFXSYQSOZCOQ-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1078466
chemicalCompound:canonicalS...
Oc1cccc2cccnc12.Oc3cccc4cccnc34.OS(=O)(=O)O
lld:chembl
chemicalCompound:1078466
chemicalCompound:molecularF...
C18H16N2O6S
lld:chembl
chemicalCompound:1078466
chemicalCompound:moleculeId
1078466
lld:chembl
chemicalCompound:1078466
chemicalCompound:mwFreebase
145.158
lld:chembl
chemicalCompound:1078466
chemicalCompound:alogp
1.774
lld:chembl
chemicalCompound:1078466
chemicalCompound:hba
2
lld:chembl
chemicalCompound:1078466
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:1078466
chemicalCompound:psa
33.12
lld:chembl
chemicalCompound:1078466
chemicalCompound:rtb
0
lld:chembl
chemicalCompound:1078466
chemicalCompound:ro3Pass
Y
lld:chembl
chemicalCompound:1078466
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1078466
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:1078466
chemicalCompound:acdMostApk...
5.058
lld:chembl
chemicalCompound:1078466
chemicalCompound:acdLogP
1.901
lld:chembl
chemicalCompound:1078466
chemicalCompound:acdLogD
0.818
lld:chembl
chemicalCompound:1078466
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
lld:chembl
chemicalCompound:1078466
chemicalCompound:fullMwt
388.394
lld:chembl
chemicalCompound:1078466
chemicalCompound:acdMostBpk...
9.81
lld:chembl
chemicalCompound:1078466
chemicalCompound:chemblId
CHEMBL1697698
lld:chembl
chemicalCompound:1078466
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1078466
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1078466
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1078466
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1078466
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1078466
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1078466
chemicalCompound:activity
activity:5316025
lld:chembl
chemicalCompound:1078466
chemicalCompound:activity
activity:5316961
lld:chembl
chemicalCompound:1078466
chemicalCompound:activity
activity:7840082
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1078466
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1078466
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1078466
lld:chembl