COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK126449
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]prop-2-enenitrile
Smiles: CCOc1cc(ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/C=C(/c1nc2c([nH]1)cccc2)\C#N

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Molecular Weight: 471.43
Empirical Formula: C24H17N5O6

Physical State: Dry powder
Available Amount: 146 mg

Lipinsky:
logP: 4.312
Rotatable bonds: 5
H-donors: 1
H-acceptors: 6
PSA: 162
Number of rings: 4

     

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