COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK380361
Chemical Name: (4Z)-4-{3-bromo-5-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-2-(4-tert-butylphenyl)-1,3-oxazol-5(4H)-one
Smiles: CCOc1cc(/C=C/2\N=C(OC2=O)c2ccc(cc2)C(C)(C)C)cc(c1OCc1ccc(cc1)[N+](=O)[O-])Br

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Molecular Weight: 579.45
Empirical Formula: C29H27BrN2O6

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 8.067
Rotatable bonds: 5
H-donors: 0
H-acceptors: 6
PSA: 102
Number of rings: 4

     

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