COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK004785
Chemical Name: ethyl6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-2-(2-ethoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Smiles: CCOC(=O)C1=C(CC(=O)OCC)OC(=C(C1c1ccc(c(c1)OC)OC)C#N)N

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Molecular Weight: 416.43
Empirical Formula: C21H24N2O7

Physical State: Dry powder
Available Amount: 538 mg

Lipinsky:
logP: 2.557
Rotatable bonds: 10
H-donors: 2
H-acceptors: 7
PSA: 130
Number of rings: 2

     

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