COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL331764
Chemical Name: (2E)-2-(1-ethyl-1H-benzimidazol-2-yl)-3-(3-nitrophenyl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cccc(c1)[N+](=O)[O-])/c1nc2c(n1CC)cccc2

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Molecular Weight: 318.33
Empirical Formula: C18H14N4O2

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 4.511
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 87
Number of rings: 3

     

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