COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK110657
Chemical Name: methyl4-(3,3,6,6-tetramethyl-1,8-dioxo-2,3,4,5,6,7,8,9-octahydro-1H-xanthen-9-yl)benzoate
Smiles: COC(=O)c1ccc(cc1)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C

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Molecular Weight: 408.49
Empirical Formula: C25H28O5

Physical State: Dry powder
Available Amount: 151 mg

Lipinsky:
logP: 4.133
Rotatable bonds: 1
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 4

     

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