COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL044232
Chemical Name: 4-{[(E)-(3-bromo-4-methoxyphenyl)methylidene]amino}-5-(3,4-dimethoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccc(cc1Br)/C=N/n1c(=S)[nH]nc1c1ccc(c(c1)OC)OC

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Molecular Weight: 449.33
Empirical Formula: C18H17BrN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.299
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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