COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK888033
Chemical Name: methyl6-bromo-2-methyl-5-{[(3-nitrophenyl)carbonyl]oxy}-1-benzofuran-3-carboxylate
Smiles: COC(=O)c1c(C)oc2c1cc(OC(=O)c1cccc(c1)[N+](=O)[O-])c(c2)Br

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Molecular Weight: 434.2
Empirical Formula: C18H12BrNO7

Physical State: Dry powder
Available Amount: 86 mg

Lipinsky:
logP: 5.178
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 111
Number of rings: 3

     

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