COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525143
Chemical Name: (5alpha,8xi,9xi,14xi,16xi,17xi)-12-oxofurost-20(22)-en-3,26-diyldiacetate
Smiles: CC(CCC1=C(C)C2C(O1)CC1[C@]2(C)C(=O)CC2C1CC[C@@H]1[C@]2(C)CCC(C1)OC(=O)C)COC(=O)C

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Molecular Weight: 514.7
Empirical Formula: C31H46O6

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 5.903
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 78
Number of rings: 5

     

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