COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK874227
Chemical Name: 4-(2-methyl-1,3-benzothiazol-3-ium-3-yl)butane-2-sulfonate
Smiles: CC(S(=O)(=O)[O-])CC[n+]1c(C)sc2c1cccc2

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Molecular Weight: 285.39
Empirical Formula: C12H15NO3S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 2

     

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