COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK663559
Chemical Name: 5-[(3,4-dimethylphenoxy)methyl]-2-(1,4-dioxa-8-azaspiro[4.5]dec-8-ylmethyl)-4-methyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Smiles: Cc1ccc(cc1C)OCc1nn(c(=S)n1C)CN1CCC2(CC1)OCCO2

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Molecular Weight: 404.53
Empirical Formula: C20H28N4O3S

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 4.908
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 81
Number of rings: 4

     

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