COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL564993
Chemical Name: methyl(5xi,9xi,13xi,17xi,18xi)-3-hydroxylup-20(29)-en-28-oate
Smiles: COC(=O)C12CC[C@H](C2C2[C@](CC1)(C)[C@]1(C)CCC3[C@](C1CC2)(C)CCC(C3(C)C)O)C(=C)C

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Molecular Weight: 470.74
Empirical Formula: C31H50O3

Physical State: Liquid
Available Amount: 300 mg

Lipinsky:
logP: 9.405
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 46
Number of rings: 5

     

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