COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK170422
Chemical Name: (5Z)-1-(1,3-benzodioxol-5-yl)-5-(3-bromo-5-ethoxy-4-methoxybenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1cc(/C=C\2/C(=O)NC(=O)N(C2=O)c2ccc3c(c2)OCO3)cc(c1OC)Br

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Molecular Weight: 489.28
Empirical Formula: C21H17BrN2O7

Physical State: Dry powder
Available Amount: 6 mg

Lipinsky:
logP: 3.626
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 103
Number of rings: 4

     

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