COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL150188
Chemical Name: (7E)-7-[(4-carboxyphenyl)iminio]-4-nitrocyclohepta-1,3,5-trien-1-olate
Smiles: OC(=O)c1ccc(cc1)/[NH+]=c/1\ccc(ccc1[O-])[N+](=O)[O-]

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Molecular Weight: 286.24
Empirical Formula: C14H10N2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.076
Rotatable bonds: 1
H-donors: 2
H-acceptors: 5
PSA: 120
Number of rings: 2

     

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