COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL171986
Chemical Name: (4Z)-4-{4-[(2-bromobenzyl)oxy]-3,5-diiodobenzylidene}-2-(4-nitrophenyl)-1,3-oxazol-5(4H)-one
Smiles: O=C1OC(=N/C/1=C\c1cc(I)c(c(c1)I)OCc1ccccc1Br)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 731.08
Empirical Formula: C23H13BrI2N2O5

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 7.816
Rotatable bonds: 2
H-donors: 0
H-acceptors: 5
PSA: 93
Number of rings: 4

     

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