COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK673742
Chemical Name: (2E)-3-(2-hydroxy-5-nitrophenyl)-2-(5-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile
Smiles: N#C/C(=C\c1cc(ccc1O)[N+](=O)[O-])/c1nc2c([nH]1)ccc(c2)C

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Saltdata: HCl
Molecular Weight: 320.31
Empirical Formula: C17H12N4O3

Physical State: Dry powder
Available Amount: 65 mg

Lipinsky:
logP: 4.695
Rotatable bonds: 3
H-donors: 2
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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