COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK080071
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-(4-nitrophenyl)but-2-enenitrile
Smiles: N#C/C(=C(\c1ccc(cc1)[N+](=O)[O-])/C)/c1nc2c([nH]1)cccc2

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Molecular Weight: 304.31
Empirical Formula: C17H12N4O2

Physical State: Dry powder
Available Amount: 445 mg

Lipinsky:
logP: 4.289
Rotatable bonds: 0
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 3

     

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