COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK623277
Chemical Name: 4-{(3E)-3-[(5-nitrothiophen-2-yl)methylidene]-2,5-dioxopyrrolidin-1-yl}benzoicacid
Smiles: O=C1C/C(=C\c2ccc(s2)[N+](=O)[O-])/C(=O)N1c1ccc(cc1)C(=O)O

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Molecular Weight: 358.33
Empirical Formula: C16H10N2O6S

Physical State: Dry powder
Available Amount: 310 mg

Lipinsky:
logP: 2.344
Rotatable bonds: 2
H-donors: 1
H-acceptors: 6
PSA: 148
Number of rings: 3

     

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