COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406067
Chemical Name: 3-(benzylsulfanyl)-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-4H-1,2,4-triazole
Smiles: Cn1c(SCc2ccccc2)nnc1c1ccc2c(c1)OCCCO2

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Molecular Weight: 353.44
Empirical Formula: C19H19N3O2S

Physical State: Dry powder
Available Amount: 149 mg

Lipinsky:
logP: 5.201
Rotatable bonds: 3
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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