COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL538978
Chemical Name: methyl3-(2H-chromen-3-yl)-3-{3-hydroxy-4-oxo-6-[(phenylsulfanyl)methyl]-4H-pyran-2-yl}propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccccc2)cc(=O)c1O)C1=Cc2c(OC1)cccc2

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Molecular Weight: 450.51
Empirical Formula: C25H22O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.486
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 107
Number of rings: 4

     

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