COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL042985
Chemical Name: 2-amino-3-[(5,8-dimethoxy-2-methylquinolin-4-yl)sulfanyl]propanoate
Smiles: COc1ccc(c2c1c(SCC(C(=O)[O-])N)cc(n2)C)OC

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Saltdata: K+
Molecular Weight: 321.38
Empirical Formula: C15H17N2O4S

Physical State: Dry powder
Available Amount: 129 mg

Lipinsky:
logP: 2.388
Rotatable bonds: 5
H-donors: 2
H-acceptors: 4
PSA: 122
Number of rings: 2

     

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