COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK250476
Chemical Name: dimethyl5-({[3-oxo-1-(phenylcarbamothioyl)piperazin-2-yl]acetyl}amino)benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)CC2C(=O)NCCN2C(=S)Nc2ccccc2)cc(c1)C(=O)OC

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Molecular Weight: 484.53
Empirical Formula: C23H24N4O6S

Physical State: Dry powder
Available Amount: 426 mg

Lipinsky:
logP: 1.188
Rotatable bonds: 6
H-donors: 3
H-acceptors: 6
PSA: 158
Number of rings: 3

     

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