SPARQL
Query
Update
Search
Quick
Advanced
Co-occurrence
RelFinder
About
Sources
Admin
System Info
Repository Management
Search Configuration
Sources
550652
Source:
http://linkedlifedata.com/resource/chembl/compound/550652
Search
Subject
Predicate
Object
All
(
37
)
Download in:
JSON
RDF
N3/Turtle
N-Triples
Named Graph
All
UniProt
NCBIGene
DrugBank
ClinicalTrials
UMLS
PubMed
Mappings
MentionedEntities
Language
All
English
Español
Português
Français
Deutsch
Русский
日本語
Български
Inference
Explicit and implicit
Explicit only
Implicit only
Statements in which the resource exists.
Subject
Predicate
Object
Context
chemicalCompound:550652
rdf:type
chembl:ChemicalCompound
lld:chembl
chemicalCompound:550652
chemicalCompound:parent
chemicalCompound:294729
lld:chembl
chemicalCompound:550652
chemicalCompound:standardIn...
InChI=1S/C21H25NO3.BrH/c1-24-17-7-4-13-10-15-14-5-6-16(23)20-21(14,18(13)19(17)25-20)8-9-22(15)11-12-2-3-12;/h4,7,12,14-15,20H,2-3,5-6,8-11H2,1H3;1H
lld:chembl
chemicalCompound:550652
chemicalCompound:standardIn...
BTGGIBXORHFUKI-UHFFFAOYSA-N
lld:chembl
chemicalCompound:550652
chemicalCompound:canonicalS...
Br.COc1ccc2CC3C4CCC(=O)C5Oc1c2C45CCN3CC6CC6
lld:chembl
chemicalCompound:550652
chemicalCompound:molecularF...
C21H26BrNO3
lld:chembl
chemicalCompound:550652
chemicalCompound:moleculeId
550652
lld:chembl
chemicalCompound:550652
chemicalCompound:mwFreebase
339.428
lld:chembl
chemicalCompound:550652
chemicalCompound:alogp
2.761
lld:chembl
chemicalCompound:550652
chemicalCompound:hba
4
lld:chembl
chemicalCompound:550652
chemicalCompound:hbd
0
lld:chembl
chemicalCompound:550652
chemicalCompound:psa
38.76
lld:chembl
chemicalCompound:550652
chemicalCompound:rtb
3
lld:chembl
chemicalCompound:550652
chemicalCompound:ro3Pass
N
lld:chembl
chemicalCompound:550652
chemicalCompound:numRo5viol...
0
lld:chembl
chemicalCompound:550652
chemicalCompound:medChemFri...
Y
lld:chembl
chemicalCompound:550652
chemicalCompound:acdLogP
3.468
lld:chembl
chemicalCompound:550652
chemicalCompound:acdLogD
2.394
lld:chembl
chemicalCompound:550652
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
lld:chembl
chemicalCompound:550652
chemicalCompound:fullMwt
420.34
lld:chembl
chemicalCompound:550652
chemicalCompound:acdMostBpk...
8.439
lld:chembl
chemicalCompound:550652
chemicalCompound:chemblId
CHEMBL540004
lld:chembl
chemicalCompound:550652
chemicalCompound:maxPhase
0
lld:chembl
chemicalCompound:550652
chemicalCompound:therapeuti...
0
lld:chembl
chemicalCompound:550652
chemicalCompound:dosedIngre...
No
lld:chembl
chemicalCompound:550652
chemicalCompound:structureT...
structureType:MOL
lld:chembl
chemicalCompound:550652
chemicalCompound:chebi
https://linkedlifedata.com/...
lld:chembl
chemicalCompound:550652
chemicalCompound:moleculeTy...
moleculeType:Small molecule
lld:chembl
chemicalCompound:550652
chemicalCompound:oral
No
lld:chembl
chemicalCompound:550652
chemicalCompound:parenteral
No
lld:chembl
chemicalCompound:550652
chemicalCompound:topical
No
lld:chembl
chemicalCompound:550652
chemicalCompound:blackBoxWa...
No
lld:chembl
chemicalCompound:550652
chemicalCompound:naturalPro...
No
lld:chembl
chemicalCompound:550652
chemicalCompound:proDrug
No
lld:chembl
chemicalCompound:550652
chemicalCompound:activity
activity:849160
lld:chembl
chemicalCompound:550652
chemicalCompound:activity
activity:849161
lld:chembl
http://linkedlifedata.com/r...
http://linkedlifedata.com/r...
chemicalCompound:550652
lld:chembl