COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL511063
Chemical Name: 4-[({5-[(E)-2-carboxyethenyl]-2,3-dimethoxyphenyl}sulfonyl)amino]butanoicacid
Smiles: COc1cc(/C=C/C(=O)O)cc(c1OC)S(=O)(=O)NCCCC(=O)O

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Molecular Weight: 373.38
Empirical Formula: C15H19NO8S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.456
Rotatable bonds: 11
H-donors: 3
H-acceptors: 8
PSA: 147
Number of rings: 1

     

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