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854221
Source:
http://linkedlifedata.com/resource/chembl/compound/854221
Search
Subject
Predicate
Object
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(
52
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:854221
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:854221
chemicalCompound:standardIn...
InChI=1S/C19H20Cl3N3O2S/c1-12-8-9-13(2)15(10-12)23-17(28)24-16(19(20,21)22)25-18(26)27-11-14-6-4-3-5-7-14/h3-10,16H,11H2,1-2H3,(H,25,26)(H2,23,24,28)
lld:chembl
chemicalCompound:854221
chemicalCompound:standardIn...
ONTVJSXGROTINI-UHFFFAOYSA-N
lld:chembl
chemicalCompound:854221
chemicalCompound:canonicalS...
Cc1ccc(C)c(NC(=NC(NC(=O)OCc2ccccc2)C(Cl)(Cl)Cl)S)c1
lld:chembl
chemicalCompound:854221
chemicalCompound:molecularF...
C19H20Cl3N3O2S
lld:chembl
chemicalCompound:854221
chemicalCompound:moleculeId
854221
lld:chembl
chemicalCompound:854221
chemicalCompound:mwFreebase
460.805
lld:chembl
chemicalCompound:854221
chemicalCompound:alogp
6.419
lld:chembl
chemicalCompound:854221
chemicalCompound:hba
5
lld:chembl
chemicalCompound:854221
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:854221
chemicalCompound:psa
101.52
lld:chembl
chemicalCompound:854221
chemicalCompound:rtb
8
lld:chembl
chemicalCompound:854221
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:854221
chemicalCompound:numRo5viol...
1
lld:chembl
chemicalCompound:854221
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:854221
chemicalCompound:acdMostApk...
7.973
lld:chembl
chemicalCompound:854221
chemicalCompound:acdLogP
6.744
lld:chembl
chemicalCompound:854221
chemicalCompound:acdLogD
4.143
lld:chembl
chemicalCompound:854221
chemicalCompound:molecularS...
molecularSpecies:BASE
lld:chembl
chemicalCompound:854221
chemicalCompound:fullMwt
460.805
lld:chembl
chemicalCompound:854221
chemicalCompound:acdMostBpk...
12.098
lld:chembl
chemicalCompound:854221
chemicalCompound:chemblId
CHEMBL1430337
lld:chembl
chemicalCompound:854221
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:854221
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:854221
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:854221
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:854221
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:854221
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:854221
chemicalCompound:oral
No
lld:chembl
chemicalCompound:854221
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:854221
chemicalCompound:topical
No
lld:chembl
chemicalCompound:854221
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:854221
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:854221
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:3992647
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:4110255
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:4527750
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:4996085
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5409686
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5465453
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5530667
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5538333
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5741512
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5855496
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5860122
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5881619
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:5977666
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:6668342
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:7112123
lld:chembl
chemicalCompound:854221
chemicalCompound:activity
activity:7487839
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:854221
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:854221
lld:chembl