COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK594702
Chemical Name: 5-(2-bromophenyl)-4-{[(E)-(2,4,5-trimethoxyphenyl)methylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1cc(OC)c(cc1/C=N/n1c(=S)[nH]nc1c1ccccc1Br)OC

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Molecular Weight: 449.33
Empirical Formula: C18H17BrN4O3S

Physical State: Dry powder
Available Amount: 210 mg

Lipinsky:
logP: 3.21
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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