COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK864985
Chemical Name: dimethyl2-{[(1-oxo-1H-isothiochromen-3-yl)carbonyl]amino}benzene-1,4-dicarboxylate
Smiles: COC(=O)c1ccc(cc1NC(=O)c1cc2ccccc2c(=O)s1)C(=O)OC

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Molecular Weight: 397.41
Empirical Formula: C20H15NO6S

Physical State: Dry powder
Available Amount: 90 mg

Lipinsky:
logP: 5.291
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 124
Number of rings: 3

     

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