COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK164896
Chemical Name: dimethyl5-({[2-(4-sulfamoylphenyl)ethyl]carbamothioyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=S)NCCc2ccc(cc2)S(=O)(=O)N)cc(c1)C(=O)OC

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Molecular Weight: 451.52
Empirical Formula: C19H21N3O6S2

Physical State: Dry powder
Available Amount: 122 mg

Lipinsky:
logP: 2.119
Rotatable bonds: 6
H-donors: 4
H-acceptors: 6
PSA: 177
Number of rings: 2

     

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