COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL426933
Chemical Name: 3,3,6,6-tetramethyl-9-{4-[(2-methylbenzyl)oxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Smiles: O=C1CC(C)(C)CC2=C1C(c1ccc(cc1)OCc1ccccc1C)C1=C(O2)CC(CC1=O)(C)C

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Molecular Weight: 470.61
Empirical Formula: C31H34O4

Physical State: Dry powder
Available Amount: 108 mg

Lipinsky:
logP: 6.186
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 5

     

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