COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL507488
Chemical Name: 5-{[(E)-(4-bromo-3-nitrophenyl)methylidene]amino}-1,3-dihydro-2H-benzimidazol-2-one
Smiles: [O-][N+](=O)c1cc(/C=N/c2ccc3c(c2)[nH]c(=O)[nH]3)ccc1Br

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Molecular Weight: 361.15
Empirical Formula: C14H9BrN4O3

Physical State: Dry powder
Available Amount: 1199 mg

Lipinsky:
logP: 2.778
Rotatable bonds: 1
H-donors: 2
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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