COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK846128
Chemical Name: 5-(4-tert-butylphenyl)-4-{[(1E,2E)-3-(2-methoxyphenyl)prop-2-en-1-ylidene]amino}-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: COc1ccccc1/C=C/C=N/n1c(=S)[nH]nc1c1ccc(cc1)C(C)(C)C

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Molecular Weight: 392.52
Empirical Formula: C22H24N4OS

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.34
Rotatable bonds: 4
H-donors: 1
H-acceptors: 1
PSA: 81
Number of rings: 3

     

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