COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434585
Chemical Name: methyl3-(3-bromo-4-fluorophenyl)-3-(6-{[(4-chlorophenyl)sulfanyl]methyl}-3-hydroxy-4-oxo-4H-pyran-2-yl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccc(cc2)Cl)cc(=O)c1O)c1ccc(c(c1)Br)F

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Molecular Weight: 527.8
Empirical Formula: C22H17BrClFO5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 6.498
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 98
Number of rings: 3

     

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