COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL062497
Chemical Name: methyl4-[({4-[benzyl(methyl)sulfamoyl]phenyl}carbamothioyl)amino]-4-oxobutanoate
Smiles: COC(=O)CCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)N(Cc1ccccc1)C

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Molecular Weight: 449.55
Empirical Formula: C20H23N3O5S2

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.046
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 145
Number of rings: 2

     

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