COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265277
Chemical Name: 4-[(E)-2-cyano-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)ethenyl]phenylpropanoate
Smiles: CCC(=O)Oc1ccc(cc1)/C=C(/c1nnc2n1CCCCC2)\C#N

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Molecular Weight: 336.39
Empirical Formula: C19H20N4O2

Available Amount: 0 mg

Lipinsky:
logP: 2.999
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 80
Number of rings: 3

     

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