COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL038977
Chemical Name: (5E)-2,6-dihydroxy-5-{[5-(4-methyl-3-nitrophenyl)furan-2-yl]methylidene}pyrimidin-4(5H)-one
Smiles: OC1=NC(=O)/C(=C/c2ccc(o2)c2ccc(c(c2)[N+](=O)[O-])C)/C(=N1)O

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Molecular Weight: 341.28
Empirical Formula: C16H11N3O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.559
Rotatable bonds: 4
H-donors: 2
H-acceptors: 6
PSA: 141
Number of rings: 3

     

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