COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL073136
Chemical Name: 3,3'-[2-(3-nitrophenyl)propane-1,3-diyl]bis(4-hydroxy-6-methyl-2H-pyran-2-one)
Smiles: Cc1cc(O)c(c(=O)o1)CC(c1cccc(c1)[N+](=O)[O-])Cc1c(O)cc(oc1=O)C

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Molecular Weight: 413.38
Empirical Formula: C21H19NO8

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 2.718
Rotatable bonds: 7
H-donors: 2
H-acceptors: 8
PSA: 138
Number of rings: 3

     

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