COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL539247
Chemical Name: methyl3-[3-hydroxy-4-oxo-6-({[4-(propan-2-yl)phenyl]sulfanyl}methyl)-4H-pyran-2-yl]-3-(4-hydroxyphenyl)propanoate
Smiles: COC(=O)CC(c1oc(CSc2ccc(cc2)C(C)C)cc(=O)c1O)c1ccc(cc1)O

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Molecular Weight: 454.54
Empirical Formula: C25H26O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.339
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 118
Number of rings: 3

     

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