COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524955
Chemical Name: 4-{[(8xi,9xi,11alpha,14xi,17xi)-3,20-dioxopregn-4-en-11-yl]oxy}-4-oxobutanoicacid
Smiles: O=C(O[C@@H]1C[C@@]2(C)C(C3C1[C@@]1(C)CCC(=O)C=C1CC3)CCC2C(=O)C)CCC(=O)O

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Molecular Weight: 430.54
Empirical Formula: C25H34O6

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 2.67
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 97
Number of rings: 4

     

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