COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK094731
Chemical Name: 2-{2-[(3-hydroxypropyl)amino]-1H-benzimidazol-1-yl}-1-(4-nitrophenyl)ethanone
Smiles: OCCCNc1nc2c(n1CC(=O)c1ccc(cc1)[N+](=O)[O-])cccc2

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Saltdata: HBr
Molecular Weight: 354.37
Empirical Formula: C18H18N4O4

Physical State: Dry powder
Available Amount: 219 mg

Lipinsky:
logP: 2.339
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 112
Number of rings: 3

     

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