COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK104936
Chemical Name: 4-[(5-bromo-2-methoxybenzylidene)amino]-5-(4-chlorophenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1/C=N\n1c(S)nnc1c1ccc(cc1)Cl)Br

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Molecular Weight: 423.72
Empirical Formula: C16H12BrClN4OS

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 6.553
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 91
Number of rings: 3

     

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