COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525803
Chemical Name: (8xi,9xi,14xi,17xi)-3,20-dioxopregn-4-en-21-ylbenzoate
Smiles: O=C1CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)COC(=O)c1ccccc1)C)C

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Molecular Weight: 434.58
Empirical Formula: C28H34O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.156
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 5

     

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