COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406061
Chemical Name: 3-[(2-chlorobenzyl)sulfanyl]-5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-methyl-4H-1,2,4-triazole
Smiles: Clc1ccccc1CSc1nnc(n1C)c1ccc2c(c1)OCCCO2

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Molecular Weight: 387.89
Empirical Formula: C19H18ClN3O2S

Physical State: Dry powder
Available Amount: 85 mg

Lipinsky:
logP: 5.796
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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