COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK302081
Chemical Name: [2-({3-[(2-hydroxyethyl)sulfanyl]-5-nitrophenyl}amino)-2-oxoethoxy]aceticacid
Smiles: OCCSc1cc(NC(=O)COCC(=O)O)cc(c1)[N+](=O)[O-]

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Molecular Weight: 330.32
Empirical Formula: C12H14N2O7S

Physical State: Dry powder
Available Amount: 24 mg

Lipinsky:
logP: 1.42
Rotatable bonds: 9
H-donors: 3
H-acceptors: 7
PSA: 166
Number of rings: 1

     

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