COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL139332
Chemical Name: dimethyl2-({[4-(2-hydroxyethyl)piperazin-1-yl]carbonothioyl}amino)benzene-1,4-dicarboxylate
Smiles: OCCN1CCN(CC1)C(=S)Nc1cc(ccc1C(=O)OC)C(=O)OC

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Molecular Weight: 381.45
Empirical Formula: C17H23N3O5S

Available Amount: 0 mg

Lipinsky:
logP: 2.389
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 123
Number of rings: 2

     

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