COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL547202
Chemical Name: 1-{[({[(3E,8xi,9xi,14xi)-17-hydroxypregn-4-en-20-yn-3-ylidene]amino}oxy)acetyl]oxy}pyrrolidine-2,5-dione
Smiles: C#C[C@@]1(O)CCC2[C@]1(C)CCC1C2CCC2=C/C(=N/OCC(=O)ON3C(=O)CCC3=O)/CC[C@]12C

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Molecular Weight: 482.58
Empirical Formula: C27H34N2O6

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 3.043
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 105
Number of rings: 5

     

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