COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525050
Chemical Name: (3alpha,8xi,9xi,14xi,16xi,17xi,20xi,22xi)-spirostan-3-yloctanoate
Smiles: CCCCCCCC(=O)O[C@@H]1CC[C@]2(C(C1)CCC1C2CC[C@]2(C1CC1C2C(C)C2(O1)CCC(CO2)C)C)C

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Molecular Weight: 542.84
Empirical Formula: C35H58O4

Physical State: Dry powder
Available Amount: 224 mg

Lipinsky:
logP: 10.29
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 44
Number of rings: 6

     

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