COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK028949
Chemical Name: ethyl4-{[(2E)-2-cyano-3-{3-ethoxy-4-[(4-fluorobenzyl)oxy]phenyl}prop-2-enoyl]amino}benzoate
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)F)/C=C(/C(=O)Nc1ccc(cc1)C(=O)OCC)\C#N

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Molecular Weight: 488.52
Empirical Formula: C28H25FN2O5

Physical State: Dry powder
Available Amount: 315 mg

Lipinsky:
logP: 6.392
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 97
Number of rings: 3

     

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