COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045390
Chemical Name: 4-[2,5-dioxo-3-(4-phenylpiperazin-1-ium-1-yl)pyrrolidin-1-yl]benzoate
Smiles: [O-]C(=O)c1ccc(cc1)N1C(=O)CC(C1=O)[NH+]1CCN(CC1)c1ccccc1

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Molecular Weight: 379.42
Empirical Formula: C21H21N3O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.509
Rotatable bonds: 1
H-donors: 1
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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