COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524869
Chemical Name: (3alpha,6alpha,8xi,9xi,14xi,17xi)-20-methyl-20,21-epoxypregnane-3,6-diol
Smiles: O[C@@H]1CC[C@]2(C(C1)[C@@H](O)CC1C2CC[C@]2(C1CCC2C1(C)CO1)C)C

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Molecular Weight: 348.53
Empirical Formula: C22H36O3

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 3.577
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 52
Number of rings: 5

     

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