COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265242
Chemical Name: 4-[(Z)-2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethenyl]-2-ethoxyphenylacetate
Smiles: CCOc1cc(ccc1OC(=O)C)/C=C(\c1nnc2n1CCCCC2)/C#N

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Molecular Weight: 366.42
Empirical Formula: C20H22N4O3

Available Amount: 0 mg

Lipinsky:
logP: 2.884
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 90
Number of rings: 3

     

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