COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547680
Chemical Name: (8xi,9xi,14xi,16alpha,17xi)-3-hydroxy-16-methylpregn-5-en-20-one
Smiles: OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3C[C@H](C2C(=O)C)C)C)C1)C

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Molecular Weight: 330.51
Empirical Formula: C22H34O2

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 5.015
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 37
Number of rings: 4

     

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