COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL182678
Chemical Name: [(5-{2-[(2,4-dimethylphenyl)amino]-2-oxoethyl}-4-ethyl-4H-1,2,4-triazol-3-yl)sulfanyl]aceticacid
Smiles: CCn1c(nnc1SCC(=O)O)CC(=O)Nc1ccc(cc1C)C

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Molecular Weight: 348.43
Empirical Formula: C16H20N4O3S

Physical State: Dry powder
Available Amount: 112 mg

Lipinsky:
logP: 2.77
Rotatable bonds: 7
H-donors: 2
H-acceptors: 3
PSA: 122
Number of rings: 2

     

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