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710904
Source:
http://linkedlifedata.com/resource/chembl/compound/710904
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Subject
Predicate
Object
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(
37
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:710904
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:710904
chemicalCompound:standardIn...
InChI=1S/C22H22N4O4S/c1-14-6-7-19(28-3)18(11-14)23-20(27)13-31-22-25-24-21(17-8-10-29-15(17)2)26(22)12-16-5-4-9-30-16/h4-11H,12-13H2,1-3H3,(H,23,27)
lld:chembl
chemicalCompound:710904
chemicalCompound:standardIn...
JIQXSKRWMHMIHA-UHFFFAOYSA-N
lld:chembl
chemicalCompound:710904
chemicalCompound:canonicalS...
COc1ccc(C)cc1NC(=O)CSc2nnc(c3ccoc3C)n2Cc4occc4
lld:chembl
chemicalCompound:710904
chemicalCompound:molecularF...
C22H22N4O4S
lld:chembl
chemicalCompound:710904
chemicalCompound:moleculeId
710904
lld:chembl
chemicalCompound:710904
chemicalCompound:mwFreebase
438.499
lld:chembl
chemicalCompound:710904
chemicalCompound:alogp
3.529
lld:chembl
chemicalCompound:710904
chemicalCompound:hba
5
lld:chembl
chemicalCompound:710904
chemicalCompound:hbd
1
lld:chembl
chemicalCompound:710904
chemicalCompound:psa
120.62
lld:chembl
chemicalCompound:710904
chemicalCompound:rtb
8
lld:chembl
chemicalCompound:710904
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:710904
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:710904
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:710904
chemicalCompound:acdMostApk...
12.322
lld:chembl
chemicalCompound:710904
chemicalCompound:acdLogP
3.764
lld:chembl
chemicalCompound:710904
chemicalCompound:acdLogD
3.764
lld:chembl
chemicalCompound:710904
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:710904
chemicalCompound:fullMwt
438.499
lld:chembl
chemicalCompound:710904
chemicalCompound:acdMostBpk...
1.565
lld:chembl
chemicalCompound:710904
chemicalCompound:chemblId
CHEMBL1271649
lld:chembl
chemicalCompound:710904
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:710904
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:710904
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:710904
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:710904
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:710904
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:710904
chemicalCompound:oral
No
lld:chembl
chemicalCompound:710904
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:710904
chemicalCompound:topical
No
lld:chembl
chemicalCompound:710904
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:710904
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:710904
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:710904
chemicalCompound:activity
activity:3531438
lld:chembl
chemicalCompound:710904
chemicalCompound:activity
activity:3531473
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:710904
lld:chembl