COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL300036
Chemical Name: 3-[({5-[(E)-2-carboxyethenyl]-2,3-dimethoxyphenyl}sulfonyl)amino]benzoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)Nc1cccc(c1)C(=O)O

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Molecular Weight: 407.4
Empirical Formula: C18H17NO8S

Physical State: Dry powder
Available Amount: 186 mg

Lipinsky:
logP: 3.067
Rotatable bonds: 8
H-donors: 3
H-acceptors: 8
PSA: 147
Number of rings: 2

     

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