COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK687845
Chemical Name: 4-acetyl-1-(2-ethylhexyl)-3-hydroxy-5-(4-hydroxy-3-methoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one
Smiles: CCCCC(CN1C(c2ccc(c(c2)OC)O)C(=C(C1=O)O)C(=O)C)CC

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Molecular Weight: 375.46
Empirical Formula: C21H29NO5

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 3.369
Rotatable bonds: 11
H-donors: 2
H-acceptors: 5
PSA: 87
Number of rings: 2

     

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