COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526306
Chemical Name: ethyl4-{[2-({[(3aR,5aR,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl]carbonyl}amino)propanoyl]amino}benzoate(non-preferredname)
Smiles: CCOC(=O)c1ccc(cc1)NC(=O)C(NC(=O)C1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)C)C

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Molecular Weight: 492.53
Empirical Formula: C24H32N2O9

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.841
Rotatable bonds: 5
H-donors: 2
H-acceptors: 9
PSA: 130
Number of rings: 4

     

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