COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL484883
Chemical Name: 2-(4-nitrophenyl)-2-oxoethyl4-[(2-methylpiperidin-1-yl)sulfonyl]benzoate
Smiles: CC1CCCCN1S(=O)(=O)c1ccc(cc1)C(=O)OCC(=O)c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 446.48
Empirical Formula: C21H22N2O7S

Physical State: Dry powder
Available Amount: 630 mg

Lipinsky:
logP: 4.508
Rotatable bonds: 3
H-donors: 0
H-acceptors: 7
PSA: 134
Number of rings: 3

     

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