COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK850678
Chemical Name: methyl4-[2-amino-3-cyano-6-(hydroxymethyl)-8-oxo-4,8-dihydropyrano[3,2-b]pyran-4-yl]benzoate
Smiles: COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1oc(CO)cc2=O)C#N

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Molecular Weight: 354.32
Empirical Formula: C18H14N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 0.814
Rotatable bonds: 3
H-donors: 3
H-acceptors: 6
PSA: 131
Number of rings: 3

     

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