COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL321588
Chemical Name: 2,2'-[(3,4-dimethoxyphenyl)methanediyl]bis(5,5-dimethylcyclohexane-1,3-dione)
Smiles: COc1cc(ccc1OC)C(C1C(=O)CC(CC1=O)(C)C)C1C(=O)CC(CC1=O)(C)C

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Molecular Weight: 428.53
Empirical Formula: C25H32O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 2.733
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 86
Number of rings: 3

     

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