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Sources
54917
Source:
http://linkedlifedata.com/resource/chembl/compound/54917
Search
Subject
Predicate
Object
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(
40
)
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Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:54917
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:54917
chemicalCompound:standardIn...
InChI=1S/C22H25BrN6/c1-28(2)7-8-29(3)13-15-12-24-20-11-21-19(10-18(15)20)22(26-14-25-21)27-17-6-4-5-16(23)9-17/h4-6,9-12,14,24H,7-8,13H2,1-3H3,(H,25,26,27)
lld:chembl
chemicalCompound:54917
chemicalCompound:standardIn...
ZGDBKHJMLZCBJH-UHFFFAOYSA-N
lld:chembl
chemicalCompound:54917
chemicalCompound:canonicalS...
CN(C)CCN(C)Cc1c[nH]c2cc3ncnc(Nc4cccc(Br)c4)c3cc12
lld:chembl
chemicalCompound:54917
chemicalCompound:molecularF...
C22H25BrN6
lld:chembl
chemicalCompound:54917
chemicalCompound:moleculeId
54917
lld:chembl
chemicalCompound:54917
chemicalCompound:mwFreebase
453.378
lld:chembl
chemicalCompound:54917
chemicalCompound:alogp
4.094
lld:chembl
chemicalCompound:54917
chemicalCompound:hba
5
lld:chembl
chemicalCompound:54917
chemicalCompound:hbd
2
lld:chembl
chemicalCompound:54917
chemicalCompound:psa
60.08
lld:chembl
chemicalCompound:54917
chemicalCompound:rtb
7
lld:chembl
chemicalCompound:54917
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:54917
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:54917
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:54917
chemicalCompound:acdLogP
3.975
lld:chembl
chemicalCompound:54917
chemicalCompound:acdLogD
2.79
lld:chembl
chemicalCompound:54917
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:54917
chemicalCompound:fullMwt
453.378
lld:chembl
chemicalCompound:54917
chemicalCompound:acdMostBpk...
8.48
lld:chembl
chemicalCompound:54917
chemicalCompound:chemblId
CHEMBL39811
lld:chembl
chemicalCompound:54917
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:54917
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:54917
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:54917
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:54917
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:54917
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:54917
chemicalCompound:oral
No
lld:chembl
chemicalCompound:54917
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:54917
chemicalCompound:topical
No
lld:chembl
chemicalCompound:54917
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:54917
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:54917
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:54917
chemicalCompound:activity
activity:209193
lld:chembl
chemicalCompound:54917
chemicalCompound:activity
activity:209194
lld:chembl
chemicalCompound:54917
chemicalCompound:activity
activity:2390250
lld:chembl
chemicalCompound:54917
chemicalCompound:activity
activity:6261305
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:54917
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:54917
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:54917
lld:chembl