COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL003189
Chemical Name: (2E,6E)-2-benzylidene-6-(4-nitrobenzylidene)cyclohexanone
Smiles: O=C1/C(=C/c2ccc(cc2)[N+](=O)[O-])/CCC/C/1=C\c1ccccc1

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Molecular Weight: 319.36
Empirical Formula: C20H17NO3

Available Amount: 0 mg

Lipinsky:
logP: 5.793
Rotatable bonds: 0
H-donors: 0
H-acceptors: 3
PSA: 62
Number of rings: 3

     

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