SPARQL
Query
Update
Search
Quick
Advanced
Co-occurrence
RelFinder
About
Sources
Admin
System Info
Repository Management
Search Configuration
Sources
65351
Source:
http://linkedlifedata.com/resource/chembl/compound/65351
Search
Subject
(
100
of
many
)
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
rdf:type
chembl:ChemicalCompound
chemicalCompound:synonym
synonym:65351_AT-4140_RESEARCH_CODE
,
synonym:65351_CI-978_RESEARCH_CODE
,
synonym:65351_Spara_TRADE_NAME
,
synonym:65351_Sparfloxacin_BAN
,
synonym:65351_Sparfloxacin_FDA_ALTERNATIVE_NAME
,
synonym:65351_Sparfloxacin_INN
,
synonym:65351_Sparfloxacin_JAN
,
synonym:65351_Sparfloxacin_USAN
,
synonym:65351_Zagam_TRADE_NAME
chemicalCompound:standardIn...
InChI=1S/C19H22F2N4O3/c1-8-5-24(6-9(2)23-8)17-13(20)15(22)12-16(14(17)21)25(10-3-4-10)7-11(18(12)26)19(27)28/h7-10,23H,3-6,22H2,1-2H3,(H,27,28)/t8-,9+
chemicalCompound:standardIn...
DZZWHBIBMUVIIW-DTORHVGOSA-N
chemicalCompound:canonicalS...
C[C@@H]1CN(C[C@H](C)N1)c2c(F)c(N)c3C(=O)C(=CN(C4CC4)c3c2F)C(=O)O
chemicalCompound:molecularF...
C19H22F2N4O3
chemicalCompound:moleculeId
65351
chemicalCompound:mwFreebase
392.4
chemicalCompound:alogp
-1.056
chemicalCompound:hba
7
chemicalCompound:hbd
3
chemicalCompound:psa
98.9
chemicalCompound:rtb
3
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
6.418
chemicalCompound:acdLogP
2.598
chemicalCompound:acdLogD
0.834
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
chemicalCompound:fullMwt
392.4
chemicalCompound:acdMostBpk...
8.589
chemicalCompound:chemblId
CHEMBL850
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
Yes
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:165351
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
Yes
chemicalCompound:parenteral
No
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
SPARFLOXACIN
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:9212
chemicalCompound:firstAppro...
1993
chemicalCompound:activity
activity:242341
,
activity:242342
,
activity:264655
,
activity:264656
,
activity:264657
,
activity:264658
,
activity:300272
,
activity:300273
,
activity:300274
,
activity:300275
,
activity:300276
,
activity:300277
,
activity:300278
,
activity:320485
,
activity:320486
,
activity:320487
,
activity:320488
,
activity:320489
,
activity:320490
,
activity:320491
,
activity:320492
,
activity:336112
,
activity:444483
,
activity:444484
,
activity:444485
,
activity:444486
,
activity:444487
,
activity:596014
,
activity:596015
,
activity:596016
,
activity:596017
,
activity:596018
,
activity:596019
,
activity:596020
,
activity:596021
,
activity:596022
,
activity:596023
,
activity:596024
,
activity:596025
,
activity:596026
,
activity:596027
,
activity:596028
,
activity:596029
,
activity:596030
,
activity:596031
,
activity:596032
,
activity:651424
,
activity:787534
,
activity:787535
,
activity:787536
,
activity:787537
,
activity:787538
,
activity:787539
,
activity:787540
More...