COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120605
Chemical Name: 3,4-dichloro-N-{[4-methyl-5-({2-oxo-2-[(2,4,6-trichlorophenyl)amino]ethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]methyl}benzamide
Smiles: O=C(Nc1c(Cl)cc(cc1Cl)Cl)CSc1nnc(n1C)CNC(=O)c1ccc(c(c1)Cl)Cl

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Molecular Weight: 553.68
Empirical Formula: C19H14Cl5N5O2S

Physical State: Dry powder
Available Amount: 357 mg

Lipinsky:
logP: 5.349
Rotatable bonds: 6
H-donors: 2
H-acceptors: 2
PSA: 114
Number of rings: 3

     

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