COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK400668
Chemical Name: 1-(4-bromophenyl)-2-{5-(2-hydroxyphenyl)-3-[(E)-2-(4-methoxyphenyl)ethenyl]-1H-1,2,4-triazol-1-yl}ethanone
Smiles: COc1ccc(cc1)/C=C/c1nc(n(n1)CC(=O)c1ccc(cc1)Br)c1ccccc1O

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Molecular Weight: 490.36
Empirical Formula: C25H20BrN3O3

Physical State: Dry powder
Available Amount: 93 mg

Lipinsky:
logP: 7.022
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 77
Number of rings: 4

     

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