COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL524875
Chemical Name: (5alpha,8xi,9xi,14xi,16alpha)-16-methyl-20-oxopregnane-3,17,21-triyltriacetate
Smiles: CC(=O)OCC(=O)[C@@]1(OC(=O)C)[C@H](C)CC2[C@]1(C)CCC1C2CC[C@@H]2[C@]1(C)CCC(C2)OC(=O)C

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Molecular Weight: 490.64
Empirical Formula: C28H42O7

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: 6.645
Rotatable bonds: 7
H-donors: 0
H-acceptors: 7
PSA: 95
Number of rings: 4

     

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