COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007175
Chemical Name: ethyl(1R,2S,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-fluorophenyl)-1,2,3,8a-tetrahydroindolizine-1-carboxylate
Smiles: CCOC(=O)[C@@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1ccccc1F)C(=O)N)C(=O)C

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Molecular Weight: 397.41
Empirical Formula: C21H20FN3O4

Available Amount: 0 mg

Lipinsky:
logP: 2.104
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 113
Number of rings: 3

     

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