COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK198884
Chemical Name: 9-[3-bromo-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: C#CCOc1c(Br)cc(cc1OCC)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2

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Molecular Weight: 471.35
Empirical Formula: C24H23BrO5

Physical State: Dry powder
Available Amount: 114 mg

Lipinsky:
logP: 3.087
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 61
Number of rings: 4

     

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