COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL525695
Chemical Name: (8xi,9xi,14xi,16alpha)-16,17-dihydroxy-20-oxopregn-5-ene-3,21-diyldiacetate
Smiles: CC(=O)OCC(=O)[C@@]1(O)[C@H](O)CC2[C@]1(C)CCC1C2CC=C2[C@]1(C)CCC(C2)OC(=O)C

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Molecular Weight: 448.56
Empirical Formula: C25H36O7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.625
Rotatable bonds: 6
H-donors: 2
H-acceptors: 7
PSA: 110
Number of rings: 4

     

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