COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK293060
Chemical Name: (2E)-2-(1,3-benzodioxol-5-yl)-3-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]prop-2-enenitrile
Smiles: COc1cc(ccc1c1ccc(o1)/C=C(\c1ccc2c(c1)OCO2)/C#N)[N+](=O)[O-]

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Molecular Weight: 390.35
Empirical Formula: C21H14N2O6

Physical State: Dry powder
Available Amount: 110 mg

Lipinsky:
logP: 5.601
Rotatable bonds: 4
H-donors: 0
H-acceptors: 6
PSA: 110
Number of rings: 4

     

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