COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: BBL036983
Chemical Name: 2-(4-nitrophenoxy)butanoicacid
Smiles: CCC(C(=O)O)Oc1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 225.203
Empirical Formula: C10H11NO5

Physical State: Dry powder
Available Amount: 1000 mg

Lipinsky:
logP: 2.116
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 92
Number of rings: 1

     

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