COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL000838
Chemical Name: 5-(4-tert-butylphenyl)-4-{[(1E,2E)-3-(furan-2-yl)-2-methylprop-2-en-1-ylidene]amino}-4H-1,2,4-triazole-3-thiol
Smiles: C/C(=C\c1ccco1)/C=N/n1c(S)nnc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 366.49
Empirical Formula: C20H22N4OS

Available Amount: 0 mg

Lipinsky:
logP: 7.673
Rotatable bonds: 4
H-donors: 0
H-acceptors: 1
PSA: 95
Number of rings: 3

     

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