COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK054057
Chemical Name: 4-[2-(4-methoxyphenyl)-2-oxoethyl]-1-[2-(4-methylphenyl)-2-oxoethyl]-1H-1,2,4-triazol-4-ium
Smiles: COc1ccc(cc1)C(=O)C[n+]1cnn(c1)CC(=O)c1ccc(cc1)C

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Saltdata: Br-
Molecular Weight: 350.4
Empirical Formula: C20H20N3O3

Physical State: Dry powder
Available Amount: 249 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 65
Number of rings: 3

     

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