COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL526897
Chemical Name: N-(pyridin-2-ylmethyl)-2-({[(3Z,8xi,9xi,14xi)-11,17,21-trihydroxy-20-oxopregn-4-en-3-ylidene]amino}oxy)acetamide
Smiles: OCC(=O)[C@@]1(O)CCC2[C@]1(C)CC(O)C1C2CCC2=C/C(=N\OCC(=O)NCc3ccccn3)/CC[C@]12C

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Molecular Weight: 525.65
Empirical Formula: C29H39N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.757
Rotatable bonds: 9
H-donors: 4
H-acceptors: 6
PSA: 141
Number of rings: 5

     

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