COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK678909
Chemical Name: 3-(5-cyano-1-ethyl-2-methyl-1H-3,1-benzimidazol-3-ium-3-yl)propane-1-sulfonate
Smiles: N#Cc1ccc2c(c1)[n+](CCCS(=O)(=O)[O-])c(n2CC)C

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Molecular Weight: 307.37
Empirical Formula: C14H17N3O3S

Physical State: Dry powder
Available Amount: 67 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 98
Number of rings: 2

     

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