COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK260888
Chemical Name: 3-[(1-hydroxy-4-{[(2-methyl-5-nitrophenyl)sulfonyl]amino}naphthalen-2-yl)sulfanyl]propanoicacid
Smiles: OC(=O)CCSc1cc(NS(=O)(=O)c2cc(ccc2C)[N+](=O)[O-])c2c(c1O)cccc2

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Molecular Weight: 462.5
Empirical Formula: C20H18N2O7S2

Available Amount: 0 mg

Lipinsky:
logP: 3.591
Rotatable bonds: 7
H-donors: 3
H-acceptors: 7
PSA: 183
Number of rings: 3

     

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