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Sources
1853
Source:
http://linkedlifedata.com/resource/chembl/compound/1853
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Subject
(
100
of
many
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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:1853_Factive_TRADE_NAME
,
synonym:1853_Gemifloxacin_FDA_ALTERNATIVE_NAME
,
synonym:1853_Gemifloxacin_INN
,
synonym:1853_Gemifloxacin_USAN
chemicalCompound:standardIn...
InChI=1S/C18H20FN5O4/c1-28-22-14-8-23(6-9(14)5-20)17-13(19)4-11-15(25)12(18(26)27)7-24(10-2-3-10)16(11)21-17/h4,7,9-10H,2-3,5-6,8,20H2,1H3,(H,26,27)/b22-14+
chemicalCompound:standardIn...
ZRCVYEYHRGVLOC-HYARGMPZSA-N
chemicalCompound:canonicalS...
CO\N=C\1/CN(CC1CN)c2nc3N(C=C(C(=O)O)C(=O)c3cc2F)C4CC4
chemicalCompound:molecularF...
C18H20FN5O4
chemicalCompound:moleculeId
1853
chemicalCompound:mwFreebase
389.381
chemicalCompound:alogp
-2.453
chemicalCompound:hba
9
chemicalCompound:hbd
2
chemicalCompound:psa
121.35
chemicalCompound:rtb
5
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
N
chemicalCompound:acdMostApk...
6.022
chemicalCompound:acdLogP
1.766
chemicalCompound:acdLogD
-0.71
chemicalCompound:molecularS...
molecularSpecies:ZWITTERION
chemicalCompound:fullMwt
389.381
chemicalCompound:acdMostBpk...
9.149
chemicalCompound:chemblId
CHEMBL430
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
No
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:101853
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
GEMIFLOXACIN
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:101853
chemicalCompound:firstAppro...
2003
chemicalCompound:activity
activity:734076
,
activity:734077
,
activity:734078
,
activity:734079
,
activity:734080
,
activity:734081
,
activity:734082
,
activity:734083
,
activity:734084
,
activity:734085
,
activity:734086
,
activity:734087
,
activity:734088
,
activity:734089
,
activity:745873
,
activity:745874
,
activity:745875
,
activity:745876
,
activity:745877
,
activity:745878
,
activity:745879
,
activity:745880
,
activity:745881
,
activity:745882
,
activity:745883
,
activity:745884
,
activity:745885
,
activity:745886
,
activity:745887
,
activity:745888
,
activity:745889
,
activity:745890
,
activity:745891
,
activity:745892
,
activity:745893
,
activity:745894
,
activity:745895
,
activity:745896
,
activity:745897
,
activity:745898
,
activity:745899
,
activity:745900
,
activity:745901
,
activity:745902
,
activity:745903
,
activity:745904
,
activity:947384
,
activity:947385
,
activity:947386
,
activity:947387
,
activity:947388
,
activity:947389
,
activity:947390
,
activity:947391
,
activity:1108987
,
activity:1108988
,
activity:1108989
,
activity:1108990
,
activity:1108991
More...