COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL029913
Chemical Name: (3beta,16alpha)-3-hydroxy-16,17-epoxypregn-5-en-20-one
Smiles: O[C@H]1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3C[C@@H]3[C@]2(O3)C(=O)C)C)C1)C

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Molecular Weight: 330.47
Empirical Formula: C21H30O3

Physical State: Dry powder
Available Amount: 1514 mg

Lipinsky:
logP: 3.219
Rotatable bonds: 0
H-donors: 1
H-acceptors: 3
PSA: 49
Number of rings: 5

     

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