COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525410
Chemical Name: (5alpha,8xi,9xi,14xi,16alpha)-5-bromo-6-fluoro-3-hydroxy-20-oxo-16,17-epoxypregnan-21-ylacetate
Smiles: OC1CC[C@]2([C@@](C1)(Br)C(F)CC1C2CC[C@]2(C1C[C@@H]1[C@]2(O1)C(=O)COC(=O)C)C)C

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Molecular Weight: 487.41
Empirical Formula: C23H32BrFO5

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.918
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 76
Number of rings: 5

     

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