COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL488049
Chemical Name: 2-{[1-(4-methoxyphenyl)-2-nitroethyl]sulfanyl}benzoicacid
Smiles: COc1ccc(cc1)C(Sc1ccccc1C(=O)O)C[N+](=O)[O-]

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Molecular Weight: 333.36
Empirical Formula: C16H15NO5S

Available Amount: 0 mg

Lipinsky:
logP: 3.539
Rotatable bonds: 5
H-donors: 1
H-acceptors: 5
PSA: 117
Number of rings: 2

     

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