COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL272970
Chemical Name: 2-{3-amino-4-[(4-chlorophenyl)amino]-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-1-yl}-1-(2,5-dimethylphenyl)ethanone
Smiles: Clc1ccc(cc1)Nn1c(N)nn(c1=S)CC(=O)c1cc(C)ccc1C

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Molecular Weight: 387.89
Empirical Formula: C18H18ClN5OS

Available Amount: 0 mg

Lipinsky:
logP: 3.034
Rotatable bonds: 4
H-donors: 3
H-acceptors: 1
PSA: 106
Number of rings: 3

     

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