COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL327972
Chemical Name: 4-[(4-carboxylato-3,7-dimethyloctanoyl)amino]benzoate
Smiles: CC(C(C(=O)[O-])CCC(C)C)CC(=O)Nc1ccc(cc1)C(=O)[O-]

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Saltdata: 2Na+
Molecular Weight: 333.38
Empirical Formula: C18H23NO5

Physical State: Dry powder
Available Amount: 181 mg

Lipinsky:
logP: 3.969
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 109
Number of rings: 1

     

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