COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK271116
Chemical Name: 3-[(2,4-dichlorobenzyl)sulfanyl]-5-(3,4-dimethoxybenzyl)-4-ethyl-4H-1,2,4-triazole
Smiles: CCn1c(nnc1SCc1ccc(cc1Cl)Cl)Cc1ccc(c(c1)OC)OC

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Molecular Weight: 438.38
Empirical Formula: C20H21Cl2N3O2S

Physical State: Dry powder
Available Amount: 142 mg

Lipinsky:
logP: 5.699
Rotatable bonds: 8
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 3

     

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