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1222764
Source:
http://linkedlifedata.com/resource/chembl/compound/1222764
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Subject
(
38
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists as a subject.
Predicate
Object
rdf:type
chembl:ChemicalCompound
chemicalCompound:standardIn...
InChI=1S/C19H24N4OS/c1-13(2)15-6-4-14(5-7-15)12-21-18-17-16(8-11-25-17)22-19(23-18)20-9-10-24-3/h4-8,11,13H,9-10,12H2,1-3H3,(H2,20,21,22,23)
chemicalCompound:standardIn...
SVEIZWICONZVJV-UHFFFAOYSA-N
chemicalCompound:canonicalS...
COCCNc1nc(NCc2ccc(cc2)C(C)C)c3sccc3n1
chemicalCompound:molecularF...
C19H24N4OS
chemicalCompound:moleculeId
1222764
chemicalCompound:mwFreebase
356.485
chemicalCompound:alogp
4.665
chemicalCompound:hba
5
chemicalCompound:hbd
2
chemicalCompound:psa
87.31
chemicalCompound:rtb
8
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
3.692
chemicalCompound:acdLogD
3.413
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
356.485
chemicalCompound:acdMostBpk...
7.356
chemicalCompound:chemblId
CHEMBL1882193
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:1322764
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:activity
activity:6980208
,
activity:7246663
,
activity:8278599
,
activity:10306654
,
activity:10608127