COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL267483
Chemical Name: 1-(4-chlorobenzyl)-4-[(4-chlorobenzyl)amino]-3-[(4-chlorobenzyl)sulfanyl]-6-(4-chlorophenyl)-5-oxo-4,5-dihydro-1,2,4-triazin-1-ium
Smiles: Clc1ccc(cc1)CSc1n[n+](Cc2ccc(cc2)Cl)c(c(=O)n1NCc1ccc(cc1)Cl)c1ccc(cc1)Cl

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Saltdata: Cl-,HCl
Molecular Weight: 629.42
Empirical Formula: C30H23Cl4N4OS

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 5
H-donors: 1
H-acceptors: 1
PSA: 73
Number of rings: 5

     

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