COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK759556
Chemical Name: 5-{3-ethoxy-4-[(4-nitrobenzyl)oxy]benzylidene}-1,3-dimethylpyrimidine-2,4,6(1H,3H,5H)-trione
Smiles: CCOc1cc(ccc1OCc1ccc(cc1)[N+](=O)[O-])C=C1C(=O)N(C)C(=O)N(C1=O)C

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Molecular Weight: 439.42
Empirical Formula: C22H21N3O7

Physical State: Dry powder
Available Amount: 307 mg

Lipinsky:
logP: 2.407
Rotatable bonds: 5
H-donors: 0
H-acceptors: 7
PSA: 121
Number of rings: 3

     

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