COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK206910
Chemical Name: dimethyl2-({[4-(ethoxycarbonyl)piperazin-1-yl]carbonothioyl}amino)benzene-1,4-dicarboxylate
Smiles: CCOC(=O)N1CCN(CC1)C(=S)Nc1cc(ccc1C(=O)OC)C(=O)OC

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Molecular Weight: 409.46
Empirical Formula: C18H23N3O6S

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 2.693
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 129
Number of rings: 2

     

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