COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525400
Chemical Name: (3alpha,5alpha,8xi,9xi,14xi,17beta)-17-hydroxy-17-methylandrostan-3-yl3-iodobenzoate
Smiles: Ic1cccc(c1)C(=O)O[C@@H]1CC[C@]2([C@H](C1)CCC1C2CC[C@]2(C1CC[C@]2(C)O)C)C

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Molecular Weight: 536.49
Empirical Formula: C27H37IO3

Physical State: Dry powder
Available Amount: 281 mg

Lipinsky:
logP: 8.895
Rotatable bonds: 3
H-donors: 1
H-acceptors: 3
PSA: 46
Number of rings: 5

     

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