COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016309
Chemical Name: 1,3-benzodioxol-5-ylmethyl4-(6-bromo-1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Smiles: O=C1NC(=C(C(N1)c1cc2OCOc2cc1Br)C(=O)OCc1ccc2c(c1)OCO2)C

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Molecular Weight: 489.28
Empirical Formula: C21H17BrN2O7

Physical State: Dry powder
Available Amount: 268 mg

Lipinsky:
logP: 3.884
Rotatable bonds: 5
H-donors: 2
H-acceptors: 7
PSA: 104
Number of rings: 5

     

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