COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564537
Chemical Name: (E)-{1-[3-(dimethylammonio)propyl]-4,5-dioxo-2-(4-propoxyphenyl)pyrrolidin-3-ylidene}[4-(dimethylsulfamoyl)phenyl]methanolate
Smiles: CCCOc1ccc(cc1)C1/C(=C(/c2ccc(cc2)S(=O)(=O)N(C)C)\[O-])/C(=O)C(=O)N1CCC[NH+](C)C

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Molecular Weight: 529.66
Empirical Formula: C27H35N3O6S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.537
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 119
Number of rings: 3

     

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