COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525857
Chemical Name: (8xi,9xi,14xi)-3,20-dioxopregn-4-en-17-ylheptanoate
Smiles: CCCCCCC(=O)O[C@@]1(CCC2[C@]1(C)CCC1C2CCC2=CC(=O)CC[C@]12C)C(=O)C

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Molecular Weight: 442.64
Empirical Formula: C28H42O4

Physical State: Dry powder
Available Amount: 271 mg

Lipinsky:
logP: 6.271
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 60
Number of rings: 4

     

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