COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK383738
Chemical Name: 2-[(3,5-dicarboxyphenyl)amino]-5-nitrobenzenesulfonate
Smiles: OC(=O)c1cc(cc(c1)C(=O)O)Nc1ccc(cc1S(=O)(=O)[O-])[N+](=O)[O-]

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Saltdata: Na+
Molecular Weight: 381.3
Empirical Formula: C14H9N2O9S

Physical State: Dry powder
Available Amount: 3397 mg

Lipinsky:
logP: 3.527
Rotatable bonds: 4
H-donors: 3
H-acceptors: 9
PSA: 198
Number of rings: 2

     

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