COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK582606
Chemical Name: 5-[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]-3-butyl-2,6-dihydroxypyrimidin-4(3H)-one
Smiles: CCCCn1c(O)nc(c(c1=O)C(=O)/C=C/c1ccc2c(c1)OCO2)O

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Molecular Weight: 358.35
Empirical Formula: C18H18N2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.833
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 108
Number of rings: 3

     

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