COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039616
Chemical Name: 4-{[(1E,2E)-2-bromo-3-phenylprop-2-en-1-ylidene]amino}-5-(4-tert-butylphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Br/C(=C/c1ccccc1)/C=N/n1c(n[nH]c1=S)c1ccc(cc1)C(C)(C)C

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Molecular Weight: 441.39
Empirical Formula: C21H21BrN4S

Physical State: Dry powder
Available Amount: 305 mg

Lipinsky:
logP: 5.653
Rotatable bonds: 2
H-donors: 1
H-acceptors: 0
PSA: 72
Number of rings: 3

     

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