COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK820464
Chemical Name: (5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[4-(hexyloxy)-3-methoxybenzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Smiles: CCCCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2

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Molecular Weight: 493.58
Empirical Formula: C26H27N3O5S

Physical State: Dry powder
Available Amount: 332 mg

Lipinsky:
logP: 6.657
Rotatable bonds: 9
H-donors: 0
H-acceptors: 5
PSA: 110
Number of rings: 5

     

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