COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053069
Chemical Name: (5E)-5-{1-[(1,3-benzodioxol-5-ylmethyl)amino]propylidene}-6-hydroxy-3-(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
Smiles: C=CCN1C(=O)N=C(/C(=C(\NCc2ccc3c(c2)OCO3)/CC)/C1=O)O

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Molecular Weight: 357.37
Empirical Formula: C18H19N3O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.161
Rotatable bonds: 6
H-donors: 2
H-acceptors: 5
PSA: 100
Number of rings: 3

     

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