COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182880
Chemical Name: 8-ethoxy-6-(3-iodo-4,5-dimethoxyphenyl)-1,3-dimethyl-4H-cyclohepta[c]furan-4-one
Smiles: CCOc1cc(cc(=O)c2c1c(C)oc2C)c1cc(I)c(c(c1)OC)OC

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Molecular Weight: 480.3
Empirical Formula: C21H21IO5

Physical State: Dry powder
Available Amount: 480 mg

Lipinsky:
logP: 5.782
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 57
Number of rings: 3

     

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