COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL131430
Chemical Name: dimethyl2-{[benzyl(2-hydroxyethyl)carbamothioyl]amino}benzene-1,4-dicarboxylate
Smiles: OCCN(C(=S)Nc1cc(ccc1C(=O)OC)C(=O)OC)Cc1ccccc1

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Molecular Weight: 402.47
Empirical Formula: C20H22N2O5S

Physical State: Dry powder
Available Amount: 20 mg

Lipinsky:
logP: 4.052
Rotatable bonds: 8
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 2

     

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