COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525045
Chemical Name: (8xi,9xi,14xi,16alpha)-17-hydroperoxy-16-methyl-20-oxopregn-5-en-3-ylacetate
Smiles: OO[C@]1(C(=O)C)[C@H](C)CC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CCC(C2)OC(=O)C

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Molecular Weight: 404.55
Empirical Formula: C24H36O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.426
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 72
Number of rings: 4

     

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