Drug Information

Drug ID:  NPD8576
Drug Name:  Succinimide
Molecular Formula:  C4H5NO2
Canonical SMILES:  OC1=NC(=O)CC1
Standard InCHI:  InChI=1S/C4H5NO2/c6-3-1-2-4(7)5-3/h1-2H2,(H,5,6,7)
Standard InCHIKey:  KZNICNPSHKQLFF-UHFFFAOYSA-N
Max Developmental Stage:  Approved
Max Developmental Stage Source:  ChEMBL

  Structural Similarity Between NPASS Natural Products and NPD8576

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  99.03
ALogP  -0.7817
MLogP  1.57
XLogP  -0.312
HDA  3
HBD  1
Rotatable Bonds  1
TPSA  49.66
RO5 Violation  0