COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL005615
Chemical Name: (2E)-2-(1,3-benzothiazol-2-yl)-3-[2-(4-methoxyphenoxy)-4-oxo-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Smiles: COc1ccc(cc1)Oc1nc2ccccn2c(=O)c1/C=C(/c1nc2c(s1)cccc2)\C#N

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Molecular Weight: 452.49
Empirical Formula: C25H16N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.682
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 116
Number of rings: 5

     

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