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Sources
1991
Source:
http://linkedlifedata.com/resource/chembl/compound/1991
Search
Subject
(
100
of
many
)
Predicate
Object
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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:parent
chemicalCompound:15217
chemicalCompound:synonym
synonym:1991_A-44090_RESEARCH_CODE
,
synonym:1991_ABBOTT-44090_OTHER
,
synonym:1991_Depacon_TRADE_NAME
,
synonym:1991_Depakote CP_TRADE_NAME
,
synonym:1991_Depakote ER_TRADE_NAME
,
synonym:1991_Depakote_TRADE_NAME
,
synonym:1991_Divalproex sodium_FDA_ALTERNATIVE_NAME
,
synonym:1991_Sodium Valproate_JAN
,
synonym:1991_Valproate Sodium_USAN
,
synonym:1991_Valproate sodium_FDA_ALTERNATIVE_NAME
,
synonym:1991_Valproate sodium_TRADE_NAME
chemicalCompound:standardIn...
InChI=1S/C8H16O2.Na/c1-3-5-7(6-4-2)8(9)10;/h7H,3-6H2,1-2H3,(H,9,10);/q;+1/p-1
chemicalCompound:standardIn...
AEQFSUDEHCCHBT-UHFFFAOYSA-M
chemicalCompound:canonicalS...
[Na+].CCCC(CCC)C(=O)[O-]
chemicalCompound:molecularF...
C8H15NaO2
chemicalCompound:moleculeId
1991
chemicalCompound:mwFreebase
144.211
chemicalCompound:alogp
2.749
chemicalCompound:hba
2
chemicalCompound:hbd
1
chemicalCompound:psa
37.29
chemicalCompound:rtb
5
chemicalCompound:ro3Pass
N
chemicalCompound:numRo5viol...
0
chemicalCompound:medChemFri...
Y
chemicalCompound:acdMostApk...
4.816
chemicalCompound:acdLogP
2.579
chemicalCompound:acdLogD
0.023
chemicalCompound:molecularS...
molecularSpecies:ACID
chemicalCompound:fullMwt
166.193
chemicalCompound:chemblId
CHEMBL433
chemicalCompound:maxPhase
4
chemicalCompound:therapeuti...
1
chemicalCompound:dosedIngre...
Yes
chemicalCompound:structureT...
structureType:MOL
chemicalCompound:chebi
https://linkedlifedata.com/resource/chebi/id/CHEBI:101991
chemicalCompound:moleculeTy...
moleculeType:Small molecule
chemicalCompound:oral
Yes
chemicalCompound:parenteral
Yes
chemicalCompound:topical
No
chemicalCompound:blackBoxWa...
No
chemicalCompound:naturalPro...
No
chemicalCompound:proDrug
No
chemicalCompound:prefName
VALPROATE SODIUM
chemicalCompound:chebiParen...
https://linkedlifedata.com/resource/chebi/id/CHEBI:9925
chemicalCompound:firstAppro...
1983
chemicalCompound:activity
activity:158987
,
activity:158988
,
activity:158989
,
activity:158990
,
activity:158991
,
activity:158992
,
activity:293622
,
activity:293623
,
activity:293624
,
activity:293625
,
activity:293626
,
activity:293627
,
activity:293628
,
activity:293629
,
activity:293630
,
activity:340605
,
activity:340606
,
activity:340607
,
activity:340608
,
activity:340609
,
activity:340610
,
activity:340611
,
activity:340612
,
activity:495980
,
activity:495981
,
activity:495982
,
activity:594902
,
activity:594903
,
activity:594904
,
activity:594905
,
activity:594906
,
activity:1072106
,
activity:1072107
,
activity:1072108
,
activity:1181931
,
activity:1284209
,
activity:1284210
,
activity:1284211
,
activity:1284212
,
activity:1506625
,
activity:1704882
,
activity:1704883
,
activity:1704884
,
activity:2192635
,
activity:2192660
,
activity:2192675
,
activity:2192702
,
activity:2192723
,
activity:2192739
,
activity:2236950
,
activity:2236958
,
activity:2236969
More...