COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473136
Chemical Name: (2Z)-N-(1,3-benzodioxol-5-yl)-3-[2-bromo-5-ethoxy-4-(propan-2-yloxy)phenyl]-2-cyanoprop-2-enamide
Smiles: CCOc1cc(/C=C(\C(=O)Nc2ccc3c(c2)OCO3)/C#N)c(cc1OC(C)C)Br

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Molecular Weight: 473.32
Empirical Formula: C22H21BrN2O5

Physical State: Dry powder
Available Amount: 253 mg

Lipinsky:
logP: 5.979
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 89
Number of rings: 3

     

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