COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL027514
Chemical Name: methyl3-{[(1E)-2-cyano-3-oxo-3-(phenylamino)prop-1-en-1-yl]amino}-4,5-diethoxybenzoate
Smiles: CCOc1c(N/C=C(/C(=O)Nc2ccccc2)\C#N)cc(cc1OCC)C(=O)OC

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Molecular Weight: 409.44
Empirical Formula: C22H23N3O5

Physical State: Dry powder
Available Amount: 56 mg

Lipinsky:
logP: 3.868
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 109
Number of rings: 2

     

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