COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK081949
Chemical Name: methyl6-amino-5-cyano-4-(3,4-dimethoxyphenyl)-2-(2-methoxy-2-oxoethyl)-4H-pyran-3-carboxylate
Smiles: COC(=O)CC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1ccc(c(c1)OC)OC

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Molecular Weight: 388.38
Empirical Formula: C19H20N2O7

Physical State: Dry powder
Available Amount: 522 mg

Lipinsky:
logP: 1.495
Rotatable bonds: 8
H-donors: 2
H-acceptors: 7
PSA: 130
Number of rings: 2

     

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