COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK522655
Chemical Name: ethyl(2Z)-5-(1,3-benzodioxol-5-yl)-2-[5-bromo-4-(diethylamino)-2-methoxybenzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Smiles: CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1cc(Br)c(cc1OC)N(CC)CC)/s2

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Molecular Weight: 628.54
Empirical Formula: C29H30BrN3O6S

Physical State: Dry powder
Available Amount: 55 mg

Lipinsky:
logP: 8.418
Rotatable bonds: 8
H-donors: 0
H-acceptors: 6
PSA: 115
Number of rings: 5

     

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