COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546670
Chemical Name: (8xi,9xi,14xi,17xi,20S)-20-methyl-21-oxo-16,21-epoxypregn-5-ene-3,20-diyldiacetate
Smiles: CC(=O)OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC3C2[C@](C)(OC(=O)C)C(=O)O3)C)C1)C

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Molecular Weight: 444.57
Empirical Formula: C26H36O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.327
Rotatable bonds: 3
H-donors: 0
H-acceptors: 6
PSA: 78
Number of rings: 5

     

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