COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL534453
Chemical Name: (3aR,5S,5aR,8aS,8bR)-N-[2-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}amino)-2-oxoethyl]-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-carboxamide(non-preferredname)
Smiles: COc1ccc(cc1)NC(=O)CNC(=O)CNC(=O)[C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)C

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Molecular Weight: 493.51
Empirical Formula: C23H31N3O9

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 4.076
Rotatable bonds: 4
H-donors: 3
H-acceptors: 9
PSA: 142
Number of rings: 4

     

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