COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431157
Chemical Name: (2E,4E)-2-(1H-benzimidazol-2-yl)-5-(3-nitrophenyl)penta-2,4-dienenitrile
Smiles: N#C/C(=C\C=C\c1cccc(c1)[N+](=O)[O-])/c1nc2c([nH]1)cccc2

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Molecular Weight: 316.32
Empirical Formula: C18H12N4O2

Physical State: Dry powder
Available Amount: 138 mg

Lipinsky:
logP: 3.653
Rotatable bonds: 2
H-donors: 1
H-acceptors: 2
PSA: 98
Number of rings: 3

     

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