COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK510716
Chemical Name: 1-[5-{3-bromo-4-[(2-chlorobenzyl)oxy]-5-methoxyphenyl}-4-(4-ethoxyphenyl)-1-phenyl-4,5-dihydro-1H-1,2,4-triazol-3-yl]ethanone
Smiles: CCOc1ccc(cc1)N1C(=NN(C1c1cc(Br)c(c(c1)OC)OCc1ccccc1Cl)c1ccccc1)C(=O)C

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Molecular Weight: 634.96
Empirical Formula: C32H29BrClN3O4

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 6.783
Rotatable bonds: 7
H-donors: 0
H-acceptors: 4
PSA: 63
Number of rings: 5

     

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