COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL562785
Chemical Name: (5xi,9xi,13xi,17xi,18xi)-28-{[(4-methylphenyl)sulfonyl]oxy}lup-20(29)-en-3-ylacetate
Smiles: CC(=O)OC1CC[C@]2(C(C1(C)C)CC[C@@]1(C2CCC2[C@@]1(C)CCC1(C2[C@@H](CC1)C(=C)C)COS(=O)(=O)c1ccc(cc1)C)C)C

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Molecular Weight: 638.95
Empirical Formula: C39H58O5S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 11.924
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 78
Number of rings: 6

     

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