COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK443609
Chemical Name: 5-[3-(4-chloro-2-methylphenoxy)propyl]-4-(2,5-dimethoxyphenyl)-4H-1,2,4-triazole-3-thiol
Smiles: COc1ccc(cc1n1c(CCCOc2ccc(cc2C)Cl)nnc1S)OC

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Molecular Weight: 419.93
Empirical Formula: C20H22ClN3O3S

Physical State: Dry powder
Available Amount: 547 mg

Lipinsky:
logP: 6.017
Rotatable bonds: 8
H-donors: 0
H-acceptors: 3
PSA: 97
Number of rings: 3

     

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