COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK085553
Chemical Name: 2-bromo-6-[(E)-({2-[4-(dimethylamino)phenyl]-1,3-benzoxazol-5-yl}imino)methyl]-4-nitrophenol
Smiles: Brc1cc(cc(c1O)/C=N/c1ccc2c(c1)nc(o2)c1ccc(cc1)N(C)C)[N+](=O)[O-]

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Molecular Weight: 481.31
Empirical Formula: C22H17BrN4O4

Physical State: Dry powder
Available Amount: 483 mg

Lipinsky:
logP: 6.563
Rotatable bonds: 2
H-donors: 1
H-acceptors: 4
PSA: 107
Number of rings: 4

     

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