COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK138862
Chemical Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]-1-(4-phenylpiperazin-1-yl)butan-1-one
Smiles: CCC(c1cc(ccc1OCCCC(=O)N1CCN(CC1)c1ccccc1)C(CC)(C)C)(C)C

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Molecular Weight: 464.69
Empirical Formula: C30H44N2O2

Physical State: Dry powder
Available Amount: 313 mg

Lipinsky:
logP: 7.616
Rotatable bonds: 9
H-donors: 0
H-acceptors: 2
PSA: 32
Number of rings: 3

     

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