COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834844
Chemical Name: 2,6-di-tert-butyl-4-[(2,5-dimethoxyphenyl)imino]cyclohexa-2,5-dien-1-one
Smiles: COc1ccc(cc1/N=C/1\C=C(C(=O)C(=C1)C(C)(C)C)C(C)(C)C)OC

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Molecular Weight: 355.48
Empirical Formula: C22H29NO3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.668
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 47
Number of rings: 2

     

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