COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525717
Chemical Name: (8xi,14xi)-9-bromo-3,20-dioxopregna-1,4-diene-11,17,21-triyltriacetate
Smiles: CC(=O)OC1C[C@@]2(C)C(C3[C@@]1(Br)[C@@]1(C)C=CC(=O)C=C1CC3)CC[C@]2(OC(=O)C)C(=O)COC(=O)C

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Molecular Weight: 565.46
Empirical Formula: C27H33BrO8

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 4.134
Rotatable bonds: 7
H-donors: 0
H-acceptors: 8
PSA: 113
Number of rings: 4

     

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