COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL041456
Chemical Name: (4E)-1-hexadecyl-4-[hydroxy(4-methoxyphenyl)methylidene]-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(c2cccc(c2)[N+](=O)[O-])/C(=C(/c2ccc(cc2)OC)\O)/C(=O)C1=O

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Molecular Weight: 578.75
Empirical Formula: C34H46N2O6

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 10.702
Rotatable bonds: 17
H-donors: 1
H-acceptors: 6
PSA: 112
Number of rings: 3

     

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