COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK651059
Chemical Name: 6-[1-(4-bromo-3-methyl-1H-pyrazol-1-yl)ethyl]-3-(3,4-dimethoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(ccc1OC)c1nnc2n1nc(s2)C(n1cc(c(n1)C)Br)C

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Molecular Weight: 449.33
Empirical Formula: C17H17BrN6O2S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 4.971
Rotatable bonds: 5
H-donors: 0
H-acceptors: 2
PSA: 107
Number of rings: 4

     

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