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813855
Source:
http://linkedlifedata.com/resource/chembl/compound/813855
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Subject
Predicate
Object
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(
38
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:813855
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:813855
chemicalCompound:standardIn...
InChI=1S/C15H22N4O4S2/c1-17(2)24(20,21)14-4-6-15(7-5-14)25(22,23)19-12-10-18(11-13-19)9-3-8-16/h4-7H,3,9-13H2,1-2H3
lld:chembl
chemicalCompound:813855
chemicalCompound:standardIn...
PGVZSBOGDAEZNA-UHFFFAOYSA-N
lld:chembl
chemicalCompound:813855
chemicalCompound:canonicalS...
CN(C)S(=O)(=O)c1ccc(cc1)S(=O)(=O)N2CCN(CCC#N)CC2
lld:chembl
chemicalCompound:813855
chemicalCompound:molecularF...
C15H22N4O4S2
lld:chembl
chemicalCompound:813855
chemicalCompound:moleculeId
813855
lld:chembl
chemicalCompound:813855
chemicalCompound:mwFreebase
386.49
lld:chembl
chemicalCompound:813855
chemicalCompound:alogp
0
lld:chembl
chemicalCompound:813855
chemicalCompound:hba
6
lld:chembl
chemicalCompound:813855
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:813855
chemicalCompound:psa
118.54
lld:chembl
chemicalCompound:813855
chemicalCompound:rtb
6
lld:chembl
chemicalCompound:813855
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:813855
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:813855
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:813855
chemicalCompound:acdLogP
1.547
lld:chembl
chemicalCompound:813855
chemicalCompound:acdLogD
1.546
lld:chembl
chemicalCompound:813855
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:813855
chemicalCompound:fullMwt
386.49
lld:chembl
chemicalCompound:813855
chemicalCompound:acdMostBpk...
4.516
lld:chembl
chemicalCompound:813855
chemicalCompound:chemblId
CHEMBL1389971
lld:chembl
chemicalCompound:813855
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:813855
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:813855
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:813855
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:813855
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:813855
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:813855
chemicalCompound:oral
No
lld:chembl
chemicalCompound:813855
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:813855
chemicalCompound:topical
No
lld:chembl
chemicalCompound:813855
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:813855
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:813855
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:813855
chemicalCompound:activity
activity:4689481
lld:chembl
chemicalCompound:813855
chemicalCompound:activity
activity:6535400
lld:chembl
chemicalCompound:813855
chemicalCompound:activity
activity:6648789
lld:chembl
chemicalCompound:813855
chemicalCompound:activity
activity:6950889
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:813855
lld:chembl