SPARQL
Query
Update
Search
Quick
Advanced
Co-occurrence
RelFinder
About
Sources
Admin
System Info
Repository Management
Search Configuration
Sources
841
Source:
http://linkedlifedata.com/resource/chembl/compound/841
Search
Subject
(
32
)
Predicate
Object
All
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 as a subject.
Predicate
Object
chemicalCompound:standardIn...
InChI=1S/C19H17F3N4S/c20-19(21,22)13-6-7-15-16(12-13)25-18(27-14-4-2-1-3-5-14)17(24-15)26-10-8-23-9-11-26/h1-7,12,23H,8-11H2
chemicalCompound:standardIn...
OBRJYVVLWMQMIE-UHFFFAOYSA-N
chemicalCompound:canonicalS...
FC(F)(F)c1ccc2nc(N3CCNCC3)c(Sc4ccccc4)nc2c1
chemicalCompound:molecularF...
C19H17F3N4S
chemicalCompound:moleculeId
841
chemicalCompound:mwFreebase
390.425
chemicalCompound:alogp
5.016
chemicalCompound:hba
5
chemicalCompound:hbd
1
chemicalCompound:psa
66.35
chemicalCompound:rtb
4
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
1
chemicalCompound:medChemFri...
Y
chemicalCompound:acdLogP
3.426
chemicalCompound:acdLogD
2.615
chemicalCompound:molecularS...
molecularSpecies:NEUTRAL
chemicalCompound:fullMwt
390.425
chemicalCompound:acdMostBpk...
8.11
chemicalCompound:chemblId
CHEMBL269153
chemicalCompound:maxPhase
0
chemicalCompound:therapeuti...
0
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:100841
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
No
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No