COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL376446
Chemical Name: 2-({5-bromo-2-methoxy-4-[(E)-2-nitroethenyl]phenoxy}methyl)benzonitrile
Smiles: COc1cc(/C=C/[N+](=O)[O-])c(cc1OCc1ccccc1C#N)Br

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Molecular Weight: 389.21
Empirical Formula: C17H13BrN2O4

Physical State: Dry powder
Available Amount: 190 mg

Lipinsky:
logP: 4.216
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 88
Number of rings: 2

     

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