COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK473404
Chemical Name: 4-[(1E)-2-cyano-3-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-oxoprop-1-en-1-yl]-2-ethoxyphenylcyclohexanecarboxylate
Smiles: CCOc1cc(ccc1OC(=O)C1CCCCC1)/C=C(/C(=O)NCCc1ccc(c(c1)OC)OC)\C#N

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Molecular Weight: 506.6
Empirical Formula: C29H34N2O6

Physical State: Dry powder
Available Amount: 127 mg

Lipinsky:
logP: 4.816
Rotatable bonds: 12
H-donors: 1
H-acceptors: 6
PSA: 106
Number of rings: 3

     

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