COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149979
Chemical Name: (E)-[4-(dimethylsulfamoyl)phenyl]{2-(4-fluorophenyl)-4,5-dioxo-1-[2-(piperidinium-1-yl)ethyl]pyrrolidin-3-ylidene}methanolate
Smiles: Fc1ccc(cc1)C1/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\[O-])/C(=O)C(=O)N1CC[NH+]1CCCCC1

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Molecular Weight: 515.61
Empirical Formula: C26H30FN3O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.748
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 110
Number of rings: 4

     

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