COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL448748
Chemical Name: 4-[(3-bromo-4-methylphenyl)amino]-2-(3,5-dimethylbenzyl)-3-methyl-4-oxobutanoicacid
Smiles: Cc1cc(cc(c1)C)CC(C(C(=O)Nc1ccc(c(c1)Br)C)C)C(=O)O

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Molecular Weight: 418.33
Empirical Formula: C21H24BrNO3

Physical State: Dry powder
Available Amount: 84 mg

Lipinsky:
logP: 5.968
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 2

     

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