COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK834061
Chemical Name: (2E)-1-(2,4-dimethoxyphenyl)-3-[(2-methyl-5-nitrophenyl)amino]prop-2-en-1-one
Smiles: COc1ccc(c(c1)OC)C(=O)/C=C/Nc1cc(ccc1C)[N+](=O)[O-]

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Molecular Weight: 342.35
Empirical Formula: C18H18N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.537
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 93
Number of rings: 2

     

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