COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK053717
Chemical Name: 2-ethoxy-4-[(4-hydroxypiperidin-1-yl)carbonothioyl]phenyl4-methylbenzenesulfonate
Smiles: CCOc1cc(ccc1OS(=O)(=O)c1ccc(cc1)C)C(=S)N1CCC(CC1)O

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Molecular Weight: 435.57
Empirical Formula: C21H25NO5S2

Physical State: Dry powder
Available Amount: 104 mg

Lipinsky:
logP: 2.807
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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