COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL300034
Chemical Name: 4-[({5-[(E)-2-carboxyethenyl]-2,3-dimethoxyphenyl}sulfonyl)amino]-2-hydroxybenzoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)Nc1ccc(c(c1)O)C(=O)O

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Molecular Weight: 423.4
Empirical Formula: C18H17NO9S

Physical State: Dry powder
Available Amount: 160 mg

Lipinsky:
logP: 3.701
Rotatable bonds: 9
H-donors: 4
H-acceptors: 9
PSA: 167
Number of rings: 2

     

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