COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK179025
Chemical Name: 1-[(4-chlorophenyl)sulfonyl]-N,N'-bis(3,4-dimethoxybenzyl)-1H-1,2,4-triazole-3,5-diamine
Smiles: COc1cc(CNc2nc(n(n2)S(=O)(=O)c2ccc(cc2)Cl)NCc2ccc(c(c2)OC)OC)ccc1OC

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Molecular Weight: 574.06
Empirical Formula: C26H28ClN5O6S

Physical State: Dry powder
Available Amount: 295 mg

Lipinsky:
logP: 4.315
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 134
Number of rings: 4

     

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