COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL383491
Chemical Name: methyl2-{[(2E)-3-(5-bromo-2-{[(4-methoxyphenyl)carbonyl]oxy}phenyl)-2-cyanoprop-2-enoyl]amino}benzoate
Smiles: COc1ccc(cc1)C(=O)Oc1ccc(cc1/C=C(/C(=O)Nc1ccccc1C(=O)OC)\C#N)Br

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Molecular Weight: 535.35
Empirical Formula: C26H19BrN2O6

Physical State: Dry powder
Available Amount: 120 mg

Lipinsky:
logP: 6.589
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 114
Number of rings: 3

     

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