COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL434107
Chemical Name: {amino[1-cyano-2-(3-nitrophenyl)-4,6,8-trioxo-5,7-diazaspiro[2.5]oct-1-yl]methylidene}propanedinitrile
Smiles: N#CC(=C(C1(C#N)C(C21C(=O)NC(=O)NC2=O)c1cccc(c1)[N+](=O)[O-])N)C#N

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Molecular Weight: 391.3
Empirical Formula: C17H9N7O5

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 0.972
Rotatable bonds: 2
H-donors: 4
H-acceptors: 5
PSA: 218
Number of rings: 3

     

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