COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK599083
Chemical Name: methyl6-amino-5-cyano-2-(2-methoxy-2-oxoethyl)-4-(2,4,5-trimethoxyphenyl)-4H-pyran-3-carboxylate
Smiles: COC(=O)CC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1cc(OC)c(cc1OC)OC

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Molecular Weight: 418.4
Empirical Formula: C20H22N2O8

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.34
Rotatable bonds: 9
H-donors: 2
H-acceptors: 8
PSA: 139
Number of rings: 2

     

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