COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK114271
Chemical Name: 1-(5-amino-3-phenyl-1H-1,2,4-triazol-1-yl)butan-1-one
Smiles: CCCC(=O)n1nc(nc1N)c1ccccc1

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Molecular Weight: 230.27
Empirical Formula: C12H14N4O

Physical State: Dry powder
Available Amount: 12 mg

Lipinsky:
logP: 1.997
Rotatable bonds: 2
H-donors: 2
H-acceptors: 1
PSA: 73
Number of rings: 2

     

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