COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL003947
Chemical Name: 2-(3-hexadecyl-2-imino-2,3-dihydro-1H-benzimidazol-1-yl)-1-(4-nitrophenyl)ethanone
Smiles: CCCCCCCCCCCCCCCCn1c2ccccc2n(c1=N)CC(=O)c1ccc(cc1)[N+](=O)[O-]

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Saltdata: HBr
Molecular Weight: 520.72
Empirical Formula: C31H44N4O3

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 9.588
Rotatable bonds: 17
H-donors: 1
H-acceptors: 3
PSA: 93
Number of rings: 3

     

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