COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK059154
Chemical Name: 4-{(1E)-2-cyano-3-[(2-methyl-5-nitrophenyl)amino]-3-oxoprop-1-en-1-yl}-2-ethoxyphenylbenzoate
Smiles: CCOc1cc(ccc1OC(=O)c1ccccc1)/C=C(/C(=O)Nc1cc(ccc1C)[N+](=O)[O-])\C#N

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Molecular Weight: 471.47
Empirical Formula: C26H21N3O6

Physical State: Dry powder
Available Amount: 450 mg

Lipinsky:
logP: 6.122
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 134
Number of rings: 3

     

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