COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL025046
Chemical Name: 4-[(3,20-dioxopregnan-21-yl)oxy]-4-oxobutanoate
Smiles: [O-]C(=O)CCC(=O)OCC(=O)C1CCC2C1(C)CCC1C2CCC2C1(C)CCC(=O)C2

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Saltdata: Na+
Molecular Weight: 431.55
Empirical Formula: C25H35O6

Physical State: Dry powder
Available Amount: 6582 mg

Lipinsky:
logP: 4.416
Rotatable bonds: 6
H-donors: 0
H-acceptors: 6
PSA: 100
Number of rings: 4

     

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