COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL565987
Chemical Name: (5xi,9xi,13xi,17xi,18xi)-3-hydroxy-19,28-epoxyoleanan-28-one
Smiles: 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: 456.71
Empirical Formula: C30H48O3

Physical State: Dry powder
Available Amount: 4 mg

Lipinsky:
logP: 7.829
Rotatable bonds: 1
H-donors: 1
H-acceptors: 3
PSA: 46
Number of rings: 6

     

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