COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL531234
Chemical Name: N-[({[(3E,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]serine
Smiles: OCC(C(=O)O)NC(=O)CO/N=C/1\CC[C@]2(C(=C1)CC[C@@H]1C2CC[C@]2(C1CCC2C(=O)C)C)C

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Molecular Weight: 474.6
Empirical Formula: C26H38N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.43
Rotatable bonds: 9
H-donors: 3
H-acceptors: 6
PSA: 125
Number of rings: 4

     

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