COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK064878
Chemical Name: 1-[2-(2,4-dichlorophenyl)-2-oxoethyl]-4-[2-(4-methoxyphenyl)-2-oxoethyl]-1H-1,2,4-triazol-4-ium
Smiles: COc1ccc(cc1)C(=O)C[n+]1cnn(c1)CC(=O)c1ccc(cc1Cl)Cl

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Saltdata: Br-
Molecular Weight: 405.26
Empirical Formula: C19H16Cl2N3O3

Physical State: Dry powder
Available Amount: 154 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 65
Number of rings: 3

     

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