COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL546744
Chemical Name: (3alpha,5alpha,8xi,9xi,14xi)-17-oxoandrostan-3-yl3-iodobenzoate
Smiles: Ic1cccc(c1)C(=O)O[C@@H]1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CCC2=O)C)C

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Molecular Weight: 520.45
Empirical Formula: C26H33IO3

Physical State: Dry powder
Available Amount: 57 mg

Lipinsky:
logP: 7.776
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 43
Number of rings: 5

     

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