COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK530388
Chemical Name: ethyl(1S,2R,3R,8aS)-6-acetyl-3-carbamoyl-1-cyano-2-(2-methoxyphenyl)-1,2,3,8a-tetrahydroindolizine-1-carboxylate
Smiles: CCOC(=O)[C@]1(C#N)[C@@H]2C=CC(=CN2[C@H]([C@@H]1c1ccccc1OC)C(=O)N)C(=O)C

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Molecular Weight: 409.44
Empirical Formula: C22H23N3O5

Physical State: Dry powder
Available Amount: 255 mg

Lipinsky:
logP: 1.967
Rotatable bonds: 4
H-donors: 2
H-acceptors: 5
PSA: 122
Number of rings: 3

     

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