COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565975
Chemical Name: (5xi,9xi,13xi,17xi,18xi)-28-oxo-19,28-epoxyoleanan-3-ylacetate
Smiles: CC(=O)OC1CC[C@]2(C(C1(C)C)CC[C@@]1(C2CCC2[C@@]1(C)CCC13C2C(OC3=O)C(C)(C)CC1)C)C

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Molecular Weight: 498.75
Empirical Formula: C32H50O4

Physical State: Dry powder
Available Amount: 5 mg

Lipinsky:
logP: 8.725
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 52
Number of rings: 6

     

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