COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL026810
Chemical Name: 2-[(E)-2-(2-butoxynaphthalen-1-yl)ethenyl]-6-hydroxy-5-nitropyrimidin-4(3H)-one
Smiles: CCCCOc1ccc2c(c1/C=C/c1nc(O)c(c(=O)[nH]1)[N+](=O)[O-])cccc2

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Molecular Weight: 381.39
Empirical Formula: C20H19N3O5

Physical State: Dry powder
Available Amount: 1486 mg

Lipinsky:
logP: 3.319
Rotatable bonds: 7
H-donors: 2
H-acceptors: 5
PSA: 116
Number of rings: 3

     

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