COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK065965
Chemical Name: methyl4-[(1E)-2-cyano-3-{[4-(ethoxycarbonyl)phenyl]amino}-3-oxoprop-1-en-1-yl]benzoate
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)/C(=C/c1ccc(cc1)C(=O)OC)/C#N

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Molecular Weight: 378.38
Empirical Formula: C21H18N2O5

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 4.304
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 105
Number of rings: 2

     

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