COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148363
Chemical Name: 2-{[(1-heptyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate
Smiles: CCCCCCCn1c(NCc2ccccc2[O-])[nH+]c2c1cccc2

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Molecular Weight: 337.46
Empirical Formula: C21H27N3O

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.745
Rotatable bonds: 8
H-donors: 2
H-acceptors: 1
PSA: 54
Number of rings: 3

     

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