COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK129496
Chemical Name: 2-[(1,1-dioxido-1,2-benzothiazol-3-yl)sulfanyl]ethyl(2E)-3-phenylprop-2-enoate
Smiles: O=C(/C=C/c1ccccc1)OCCSC1=NS(=O)(=O)c2c1cccc2

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Molecular Weight: 373.45
Empirical Formula: C18H15NO4S2

Physical State: Dry powder
Available Amount: 78 mg

Lipinsky:
logP: 3.893
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 98
Number of rings: 3

     

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