COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL442301
Chemical Name: 4-[(3-bromo-4-methylphenyl)amino]-3-methyl-2-(4-methylbenzyl)-4-oxobutanoicacid
Smiles: Cc1ccc(cc1)CC(C(C(=O)Nc1ccc(c(c1)Br)C)C)C(=O)O

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Molecular Weight: 404.3
Empirical Formula: C20H22BrNO3

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 5.508
Rotatable bonds: 5
H-donors: 2
H-acceptors: 3
PSA: 66
Number of rings: 2

     

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