COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK855436
Chemical Name: (5E)-3-(1,3-benzodioxol-5-yl)-5-(3-bromo-5-ethoxy-4-methoxybenzylidene)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1cc(/C=C/2\C(=NC(=O)N(C2=O)c2ccc3c(c2)OCO3)O)cc(c1OC)Br

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Molecular Weight: 489.28
Empirical Formula: C21H17BrN2O7

Physical State: Dry powder
Available Amount: 155 mg

Lipinsky:
logP: 3.636
Rotatable bonds: 5
H-donors: 1
H-acceptors: 7
PSA: 106
Number of rings: 4

     

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