COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526155
Chemical Name: (8xi,9xi,14xi)-20-oxopregna-5,16-dien-3-yl3-(3,3-dimethylpiperidin-1-yl)propanoate
Smiles: O=C(OC1CC[C@]2(C(=CCC3C2CC[C@]2(C3CC=C2C(=O)C)C)C1)C)CCN1CCCC(C1)(C)C

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Molecular Weight: 481.72
Empirical Formula: C31H47NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 7.584
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 46
Number of rings: 5

     

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