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Sources
550349
Source:
http://linkedlifedata.com/resource/chembl/compound/550349
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Subject
Predicate
Object
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(
41
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:550349
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:550349
chemicalCompound:parent
chemicalCompound:670732
lld:chembl
chemicalCompound:550349
chemicalCompound:standardIn...
InChI=1S/C22H26ClN5OS.ClH/c23-16-7-8-19(24)18(15-16)22(29)25-9-3-4-10-27-11-13-28(14-12-27)21-17-5-1-2-6-20(17)30-26-21;/h1-2,5-8,15H,3-4,9-14,24H2,(H,25,29);1H
lld:chembl
chemicalCompound:550349
chemicalCompound:standardIn...
FTYCAQOHLFJNKP-UHFFFAOYSA-N
lld:chembl
chemicalCompound:550349
chemicalCompound:canonicalS...
Cl.Nc1ccc(Cl)cc1C(=O)NCCCCN2CCN(CC2)c3nsc4ccccc34
lld:chembl
chemicalCompound:550349
chemicalCompound:molecularF...
C22H27Cl2N5OS
lld:chembl
chemicalCompound:550349
chemicalCompound:moleculeId
550349
lld:chembl
chemicalCompound:550349
chemicalCompound:mwFreebase
443.993
lld:chembl
chemicalCompound:550349
chemicalCompound:alogp
3.497
lld:chembl
chemicalCompound:550349
chemicalCompound:hba
5
lld:chembl
chemicalCompound:550349
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:550349
chemicalCompound:psa
102.73
lld:chembl
chemicalCompound:550349
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:550349
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:550349
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:550349
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:550349
chemicalCompound:acdLogP
3.614
lld:chembl
chemicalCompound:550349
chemicalCompound:acdLogD
2.863
lld:chembl
chemicalCompound:550349
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:550349
chemicalCompound:fullMwt
480.454
lld:chembl
chemicalCompound:550349
chemicalCompound:acdMostBpk...
8.254
lld:chembl
chemicalCompound:550349
chemicalCompound:chemblId
CHEMBL558192
lld:chembl
chemicalCompound:550349
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:550349
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:550349
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:550349
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:550349
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:550349
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:550349
chemicalCompound:oral
No
lld:chembl
chemicalCompound:550349
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:550349
chemicalCompound:topical
No
lld:chembl
chemicalCompound:550349
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:550349
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:550349
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011039
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011040
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011041
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011042
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011043
lld:chembl
chemicalCompound:550349
chemicalCompound:activity
activity:1011044
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:550349
lld:chembl