COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL312726
Chemical Name: methyl3-(6-{[(2-chlorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)-3-(1-methyl-1H-pyrazol-4-yl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccccc2Cl)cc(=O)c1O)c1cnn(c1)C

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Molecular Weight: 434.9
Empirical Formula: C20H19ClN2O5S

Physical State: Dry powder
Available Amount: 119 mg

Lipinsky:
logP: 3.443
Rotatable bonds: 9
H-donors: 1
H-acceptors: 5
PSA: 115
Number of rings: 3

     

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