COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK286990
Chemical Name: (2E)-2-(1H-benzimidazol-2-yl)-3-[2-(2,4-dinitrophenoxy)phenyl]prop-2-enenitrile
Smiles: N#C/C(=C\c1ccccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-])/c1nc2c([nH]1)cccc2

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Molecular Weight: 427.38
Empirical Formula: C22H13N5O5

Physical State: Dry powder
Available Amount: 132 mg

Lipinsky:
logP: 5.011
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 153
Number of rings: 4

     

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