COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK100521
Chemical Name: 2-bromo-6-[(E)-{[3-(5,6-dimethyl-1,3-benzoxazol-2-yl)phenyl]imino}methyl]-4-nitrophenol
Smiles: Oc1c(/C=N/c2cccc(c2)c2oc3c(n2)cc(c(c3)C)C)cc(cc1Br)[N+](=O)[O-]

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Molecular Weight: 466.29
Empirical Formula: C22H16BrN3O4

Physical State: Dry powder
Available Amount: 480 mg

Lipinsky:
logP: 7.127
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 104
Number of rings: 4

     

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