COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK959495
Chemical Name: methyl6-amino-5-cyano-4-{3-methoxy-4-[(4-nitrobenzyl)oxy]phenyl}-2-methyl-4H-pyran-3-carboxylate
Smiles: COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)OC)OCc1ccc(cc1)[N+](=O)[O-])C#N)N

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Molecular Weight: 451.44
Empirical Formula: C23H21N3O7

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 2.681
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 149
Number of rings: 3

     

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