COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK063417
Chemical Name: ethyl(2E)-2-cyano-3-{2-[2-(3-methylphenoxy)ethoxy]-5-nitrophenyl}prop-2-enoate
Smiles: CCOC(=O)/C(=C/c1cc(ccc1OCCOc1cccc(c1)C)[N+](=O)[O-])/C#N

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Molecular Weight: 396.4
Empirical Formula: C21H20N2O6

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 4.568
Rotatable bonds: 9
H-donors: 0
H-acceptors: 6
PSA: 114
Number of rings: 2

     

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