COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK699491
Chemical Name: (2Z)-3-(3-bromo-5-ethoxy-4-methoxyphenyl)-2-[(5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]prop-2-enoicacid
Smiles: CCOc1cc(/C=C(/C(=O)O)\Sc2nnc([nH]2)C)cc(c1OC)Br

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Molecular Weight: 414.28
Empirical Formula: C15H16BrN3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.14
Rotatable bonds: 8
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 2

     

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