COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525113
Chemical Name: (5S,10S,13S)-10,13-dimethyl-17-{3-methyl-3-[(2-methylpentan-2-yl)peroxy]but-1-yn-1-yl}hexadecahydro-1H-cyclopenta[a]phenanthrene-3,17-diyldiacetate(non-preferredname)
Smiles: CCCC(OOC(C#CC1(CCC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(C2)OC(=O)C)OC(=O)C)(C)C)(C)C

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Molecular Weight: 558.8
Empirical Formula: C34H54O6

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 9.958
Rotatable bonds: 9
H-donors: 0
H-acceptors: 6
PSA: 71
Number of rings: 4

     

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