COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK751656
Chemical Name: 2-(3-iodophenyl)-N-[(1E,2E)-3-(2-nitrophenyl)prop-2-en-1-ylidene]-1,3-benzoxazol-5-amine
Smiles: Ic1cccc(c1)c1nc2c(o1)ccc(c2)/N=C/C=C/c1ccccc1[N+](=O)[O-]

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Molecular Weight: 495.28
Empirical Formula: C22H14IN3O3

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 7.232
Rotatable bonds: 3
H-donors: 0
H-acceptors: 3
PSA: 84
Number of rings: 4

     

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