COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK118468
Chemical Name: 4-chloro-N-{[4-ethyl-5-({2-oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: CCn1c(SCC(=O)Nc2c(Cl)cc(cc2Cl)Cl)nnc1CNC(=O)c1ccc(cc1)Cl

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Molecular Weight: 533.26
Empirical Formula: C20H17Cl4N5O2S

Physical State: Dry powder
Available Amount: 195 mg

Lipinsky:
logP: 5.159
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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