COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL415849
Chemical Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-4-ethyl-5-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazole
Smiles: CCn1c(nnc1c1ccc2c(c1)OCCCO2)SCc1ccc(cc1)F

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Molecular Weight: 385.46
Empirical Formula: C20H20FN3O2S

Physical State: Dry powder
Available Amount: 45 mg

Lipinsky:
logP: 5.784
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 74
Number of rings: 4

     

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