COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL566242
Chemical Name: methyl(8xi,9xi,14xi,16alpha)-21-(acetyloxy)-16,17-dihydroxy-3,20-dioxopregna-1,4-diene-11-carboxylate
Smiles: COC(=O)C1C[C@@]2(C)C(C3C1[C@@]1(C)C=CC(=O)C=C1CC3)C[C@H]([C@]2(O)C(=O)COC(=O)C)O

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Molecular Weight: 460.52
Empirical Formula: C25H32O8

Physical State: Liquid
Available Amount: 66 mg

Lipinsky:
logP: 2.554
Rotatable bonds: 6
H-donors: 2
H-acceptors: 8
PSA: 127
Number of rings: 4

     

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