COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL145782
Chemical Name: 5-amino-N-benzyl-1-{2-[(2,6-dimethylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4-carboxamide
Smiles: O=C(Cn1nnc(c1N)C(=O)NCc1ccccc1)Nc1c(C)cccc1C

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Molecular Weight: 378.43
Empirical Formula: C20H22N6O2

Physical State: Dry powder
Available Amount: 1 mg

Lipinsky:
logP: 2.025
Rotatable bonds: 4
H-donors: 4
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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