COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564694
Chemical Name: methyl(5xi,9xi,18xi)-3-(acetyloxy)-11-oxoolean-12-en-30-oate
Smiles: COC(=O)[C@@]1(C)CC[C@]2(C(C1)C1=CC(=O)C3[C@@]([C@@]1(CC2)C)(C)CCC1[C@]3(C)CCC(C1(C)C)OC(=O)C)C

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Molecular Weight: 526.76
Empirical Formula: C33H50O5

Physical State: Liquid
Available Amount: 289 mg

Lipinsky:
logP: 7.893
Rotatable bonds: 3
H-donors: 0
H-acceptors: 5
PSA: 69
Number of rings: 5

     

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