COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL053565
Chemical Name: (4E)-1-hexadecyl-4-[hydroxy(4-nitrophenyl)methylidene]-5-(2-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(/C(=C(/c2ccc(cc2)[N+](=O)[O-])\O)/C(=O)C1=O)c1ccccc1[N+](=O)[O-]

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Molecular Weight: 593.72
Empirical Formula: C33H43N3O7

Physical State: Dry powder
Available Amount: 260 mg

Lipinsky:
logP: 10.536
Rotatable bonds: 17
H-donors: 1
H-acceptors: 7
PSA: 149
Number of rings: 3

     

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