COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150768
Chemical Name: (5E)-5-{[(1,3-benzodioxol-5-ylmethyl)amino]methylidene}-3-(2-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccccc1N1C(=O)N=C(/C(=C\NCc2ccc3c(c2)OCO3)/C1=O)O

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Molecular Weight: 409.4
Empirical Formula: C21H19N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.41
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 109
Number of rings: 4

     

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