COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL061113
Chemical Name: (3E)-3-(4-nitrobenzylidene)-9-[2-(piperidin-1-yl)ethyl]-3H-imidazo[1,2-a]benzimidazol-2(9H)-one
Smiles: O=C1N=c2n(/C/1=C/c1ccc(cc1)[N+](=O)[O-])c1c(n2CCN2CCCCC2)cccc1

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Molecular Weight: 417.47
Empirical Formula: C23H23N5O3

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 4.512
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 5

     

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