COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL148454
Chemical Name: (4E)-4-[(3-bromophenyl)(hydroxy)methylidene]-1-hexadecyl-5-(3-nitrophenyl)pyrrolidine-2,3-dione
Smiles: CCCCCCCCCCCCCCCCN1C(=O)C(=O)/C(=C(\c2cccc(c2)Br)/O)/C1c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 627.62
Empirical Formula: C33H43BrN2O5

Physical State: Dry powder
Available Amount: 258 mg

Lipinsky:
logP: 11.59
Rotatable bonds: 18
H-donors: 1
H-acceptors: 5
PSA: 103
Number of rings: 3

     

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