COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL045944
Chemical Name: (2E)-3-{4-methoxy-3-[(pyridinium-3-ylmethyl)sulfamoyl]phenyl}prop-2-enoate
Smiles: COc1ccc(cc1S(=O)(=O)NCc1ccc[nH+]c1)/C=C/C(=O)[O-]

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Molecular Weight: 348.38
Empirical Formula: C16H16N2O5S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.396
Rotatable bonds: 5
H-donors: 2
H-acceptors: 5
PSA: 118
Number of rings: 2

     

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