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1233556
Source:
http://linkedlifedata.com/resource/chembl/compound/1233556
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Subject
Predicate
Object
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(
36
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:1233556
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:1233556
chemicalCompound:standardIn...
InChI=1S/C22H30N4O3S2/c1-16-4-7-20(18(3)14-16)25-31(27,28)19-6-5-17(2)21(15-19)24-22(30)23-8-9-26-10-12-29-13-11-26/h4-7,14-15,25H,8-13H2,1-3H3,(H2,23,24,30)
lld:chembl
chemicalCompound:1233556
chemicalCompound:standardIn...
UNRMXTVKKOQBMI-UHFFFAOYSA-N
lld:chembl
chemicalCompound:1233556
chemicalCompound:canonicalS...
Cc1ccc(NS(=O)(=O)c2ccc(C)c(NC(=NCCN3CCOCC3)S)c2)c(C)c1
lld:chembl
chemicalCompound:1233556
chemicalCompound:molecularF...
C22H30N4O3S2
lld:chembl
chemicalCompound:1233556
chemicalCompound:moleculeId
1233556
lld:chembl
chemicalCompound:1233556
chemicalCompound:mwFreebase
462.629
lld:chembl
chemicalCompound:1233556
chemicalCompound:alogp
4.003
lld:chembl
chemicalCompound:1233556
chemicalCompound:hba
7
lld:chembl
chemicalCompound:1233556
chemicalCompound:hbd
3
lld:chembl
chemicalCompound:1233556
chemicalCompound:psa
130.21
lld:chembl
chemicalCompound:1233556
chemicalCompound:rtb
8
lld:chembl
chemicalCompound:1233556
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:1233556
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:1233556
chemicalCompound:medChemFri...
N
lld:chembl
chemicalCompound:1233556
chemicalCompound:acdMostApk...
-0.848
lld:chembl
chemicalCompound:1233556
chemicalCompound:acdLogP
2.51
lld:chembl
chemicalCompound:1233556
chemicalCompound:acdLogD
0
lld:chembl
chemicalCompound:1233556
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
lld:chembl
chemicalCompound:1233556
chemicalCompound:fullMwt
462.629
lld:chembl
chemicalCompound:1233556
chemicalCompound:acdMostBpk...
12.759
lld:chembl
chemicalCompound:1233556
chemicalCompound:chemblId
CHEMBL1892985
lld:chembl
chemicalCompound:1233556
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:1233556
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:1233556
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:1233556
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:1233556
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:1233556
chemicalCompound:oral
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:topical
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:1233556
chemicalCompound:activity
activity:7524323
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:1233556
lld:chembl