Drug Information

Drug ID:  NPD8593
Drug Name:  Sodium Succinate
Molecular Formula:  C4H6O4.Na
Canonical SMILES:  [O-]C(=O)CCC(=O)O.[Na+]
Standard InCHI:  InChI=1S/C4H6O4.Na/c5-3(6)1-2-4(7)8;/h1-2H2,(H,5,6)(H,7,8);/q;+1/p-1
Standard InCHIKey:  KZQSXALQTHVPDQ-UHFFFAOYSA-M
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD8593

Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.


  Similar Natural Products

High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7

Drug Structure

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External Identifiers

TTD  
DrugBank  
ChEMBL  
IUPHAR/BPS  
PharmaGKB  
KEGG Drug  
PubChem CID  
ChEBI  
CAS Number  

Drug Properties

Molecular Weight  117.02
ALogP  -1.0878
MLogP  1.46
XLogP  -1.191
HDA  4
HBD  1
Rotatable Bonds  5
TPSA  77.43
RO5 Violation  0