NPACT- Naturally occuring Plant based Anticancerous Compound-Activity-Target DataBase
CompoundMaleic acid monoethyl ester
NPACT-IdNPACT00744
IUPACmonoethyl succinate;Ethyl hydrogen succinate;mono-Ethyl succinate;4-Ethoxy-4-oxobutanoic acid
Synonyms-
PubChem Id70610
ClassOrganic chemical
In-vitro anticancer activity 2 cancer cell lines
In-Vivo anticancer activity No
TargetsNo targets found
Properties Physical   Elemental  Topological
InChi KeyLOLKAJARZKDJTD-UHFFFAOYSA-N
InChi1S/C6H10O4/c1-2-10-6(9)4-3-5(7)8/h2-4H2,1H3,(H,7,8)
SMILESO(C(=O)CCC(=O)O)CC
SMART[#6]COC(=O)CCC(O)=O
CAS No.1070-34-4
Structure
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Cross Refrence in other databases
Super Natural   -
CTD   -
HIT   -
NCI-60 GI50 data   -
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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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