COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK672551
Chemical Name: ethyl{4-[(4,4-dimethyl-2,6-dioxocyclohexyl)(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)methyl]-2-methoxyphenoxy}acetate
Smiles: CCOC(=O)COc1ccc(cc1OC)C(C1=C(O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 500.59
Empirical Formula: C28H36O8

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 3.727
Rotatable bonds: 10
H-donors: 1
H-acceptors: 8
PSA: 116
Number of rings: 3

     

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