COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL483660
Chemical Name: 2-[4-amino-5-({2-[(2,6-dichlorophenyl)amino]-2-oxoethyl}sulfanyl)-4H-1,2,4-triazol-3-yl]-1-{2-[(2,6-dichlorophenyl)amino]-2-oxoethyl}pyridinium
Smiles: O=C(Nc1c(Cl)cccc1Cl)CSc1nnc(n1N)c1cccc[n+]1CC(=O)Nc1c(Cl)cccc1Cl

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Saltdata: CI-
Molecular Weight: 598.32
Empirical Formula: C23H18Cl4N7O2S

Available Amount: 0 mg

Lipinsky:
logP: -0.632
Rotatable bonds: 6
H-donors: 4
H-acceptors: 2
PSA: 144
Number of rings: 4

     

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