COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434578
Chemical Name: methyl3-(4-chlorophenyl)-3-(6-{[(4-fluorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccc(cc2)F)cc(=O)c1O)c1ccc(cc1)Cl

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Molecular Weight: 448.9
Empirical Formula: C22H18ClFO5S

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 5.178
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 98
Number of rings: 3

     

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