COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK416101
Chemical Name: (2E)-1-(3-amino-4H-1,2,4-triazol-4-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Smiles: COc1cc(/C=C/C(=O)n2cnnc2N)ccc1OC

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Molecular Weight: 274.28
Empirical Formula: C13H14N4O3

Physical State: Dry powder
Available Amount: 320 mg

Lipinsky:
logP: 1.051
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 92
Number of rings: 2

     

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