COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL265406
Chemical Name: (2E)-3-hydroxy-2-(6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[4,3-a]azepin-3-yl)pent-2-enenitrile
Smiles: CC/C(=C(\c1nnc2n1CCCCC2)/C#N)/O

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Molecular Weight: 232.29
Empirical Formula: C12H16N4O

Available Amount: 0 mg

Lipinsky:
logP: 1.678
Rotatable bonds: 3
H-donors: 1
H-acceptors: 1
PSA: 74
Number of rings: 2

     

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