COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK201581
Chemical Name: methyl{5-bromo-4-[(Z)-2-cyano-2-(5-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenoxy}acetate
Smiles: COC(=O)COc1cc(Br)c(cc1OC)/C=C(\c1[nH]c2c(n1)cc(cc2)OC)/C#N

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Molecular Weight: 472.3
Empirical Formula: C21H18BrN3O5

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 4.128
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 106
Number of rings: 3

     

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