COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL081252
Chemical Name: 1-(4-methoxybenzyl)-2,2-dioxido-1H-2,1-benzothiazin-4-yl4-methylbenzenesulfonate
Smiles: COc1ccc(cc1)CN1c2ccccc2C(=CS1(=O)=O)OS(=O)(=O)c1ccc(cc1)C

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Molecular Weight: 471.55
Empirical Formula: C23H21NO6S2

Physical State: Dry powder
Available Amount: 115 mg

Lipinsky:
logP: 4.898
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 106
Number of rings: 4

     

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