COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK210520
Chemical Name: dimethyl5-{[(3-oxothiomorpholin-2-yl)acetyl]amino}benzene-1,3-dicarboxylate
Smiles: COC(=O)c1cc(NC(=O)CC2SCCNC2=O)cc(c1)C(=O)OC

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Molecular Weight: 366.39
Empirical Formula: C16H18N2O6S

Physical State: Dry powder
Available Amount: 553 mg

Lipinsky:
logP: 0.823
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 136
Number of rings: 2

     

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