COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK741871
Chemical Name: dimethyl2-{[(4-methylpiperazin-1-yl)carbonothioyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=S)N1CCN(CC1)C)C(=O)OC

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Molecular Weight: 351.43
Empirical Formula: C16H21N3O4S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 2.656
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 103
Number of rings: 2

     

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