COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL172200
Chemical Name: 9-(3-ethoxy-4-hydroxy-5-iodophenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: CCOc1cc(cc(c1O)I)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2

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Molecular Weight: 480.3
Empirical Formula: C21H21IO5

Physical State: Dry powder
Available Amount: 10 mg

Lipinsky:
logP: 2.538
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 4

     

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