COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK705331
Chemical Name: methyl(2E)-2-cyano-3-[2-(2,3-dimethylphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enoate
Smiles: COC(=O)/C(=C/c1c(Oc2cccc(c2C)C)nc2n(c1=O)cccc2)/C#N

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Molecular Weight: 375.38
Empirical Formula: C21H17N3O4

Physical State: Dry powder
Available Amount: 404 mg

Lipinsky:
logP: 2.639
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 91
Number of rings: 3

     

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