COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL055736
Chemical Name: (5E)-5-[(5-bromo-1H-indol-3-yl)methylidene]-3-(4-ethoxyphenyl)-6-hydroxypyrimidine-2,4(3H,5H)-dione
Smiles: CCOc1ccc(cc1)N1C(=O)N=C(/C(=C\c2c[nH]c3c2cc(Br)cc3)/C1=O)O

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Molecular Weight: 454.28
Empirical Formula: C21H16BrN3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.892
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 94
Number of rings: 4

     

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