COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK000072
Chemical Name: ethyl(1R,2R,3R,8aS)-3-acetyl-6-carbamoyl-1-cyano-2-(pyridin-3-yl)-1,2,3,8a-tetrahydroindolizine-1-carboxylate
Smiles: CCOC(=O)[C@@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1cccnc1)C(=O)C)C(=O)N

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Molecular Weight: 380.4
Empirical Formula: C20H20N4O4

Physical State: Dry powder
Available Amount: 309 mg

Lipinsky:
logP: 0.83
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 126
Number of rings: 3

     

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