Drug Information

Drug ID:  NPD8578
Drug Name:  Acesulfame Potassium
Molecular Formula:  C4H5NO4S.K
Canonical SMILES:  CC1=CC(=NS(=O)(=O)O1)[O-].[K+]
Standard InCHI:  InChI=1S/C4H5NO4S.K/c1-3-2-4(6)5-10(7,8)9-3;/h2H,1H3,(H,5,6);/q;+1/p-1
Standard InCHIKey:  WBZFUFAFFUEMEI-UHFFFAOYSA-M
Max Developmental Stage:  Phase 3
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD8578

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

Similarity Level Similarity Score Natural Product ID
Remote Similarity 0.5714 NPC86121

Drug Structure

External Identifiers

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

Drug Properties

Molecular Weight  161.99
ALogP  -1.4446
MLogP  1.24
XLogP  -0.93
HDA  5
HBD  0
Rotatable Bonds  2
TPSA  87.17
RO5 Violation  0