COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026287
Chemical Name: 2-{(E)-2-[4-(benzyloxy)-3-methoxy-5-(prop-2-en-1-yl)phenyl]ethenyl}-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: C=CCc1cc(/C=C/c2nc(O)c(c(=O)[nH]2)[N+](=O)[O-])cc(c1OCc1ccccc1)OC

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Molecular Weight: 435.44
Empirical Formula: C23H21N3O6

Available Amount: 0 mg

Lipinsky:
logP: 2.989
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 125
Number of rings: 3

     

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