COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK029770
Chemical Name: 2-(3-heptyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(4-nitrophenyl)ethanone
Smiles: CCCCCCCn1c(=N)n(c2c1cccc2)CC(=O)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: HBr
Molecular Weight: 394.47
Empirical Formula: C22H26N4O3

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 4.806
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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