NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundSodium butyrate
NPACT-IdNPACT01319
IUPAC-
SynonymsSodium butanoate;Butyrate sodium;Butyric acid sodium salt;Butanoic acid, sodium salt;Sodium n-butyrate;Sodium propanecarboxylate
PubChem Id5222465
ClassAliphatic natural products
In-vitro anticancer activity 2 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyMFBOGIVSZKQAPD-UHFFFAOYSA-M
InChi1S/C4H8O2.Na/c1-2-3-4(5)6;/h2-3H2,1H3,(H,5,6);/q;+1/p-1
SMILES[Na+].[O-]C(=O)CCC
SMART[Na;v0+].[H]C([H])([H])C([H])([H])C([H])([H])C([O-])=O
CAS No.156-54-7
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   156-54-7
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Drug-Likeliness Filters Lipinski's rule of five   Yes
Ghose filter   No
Veber filter   Yes
Muegge Filter   No
Similarity SearchHuman metabolite databaseFDA approved drugs

 






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