COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK546909
Chemical Name: 2-(4-nitrophenyl)butanedioicacid
Smiles: OC(=O)CC(c1ccc(cc1)[N+](=O)[O-])C(=O)O

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Molecular Weight: 239.18
Empirical Formula: C10H9NO6

Physical State: Dry powder
Available Amount: 259 mg

Lipinsky:
logP: 0.947
Rotatable bonds: 5
H-donors: 2
H-acceptors: 6
PSA: 120
Number of rings: 1

     

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