COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK564997
Chemical Name: (E)-furan-2-yl{1-[3-(1H-imidazol-3-ium-1-yl)propyl]-2-(3-nitrophenyl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: O=C1C(=O)/C(=C(\c2ccco2)/[O-])/C(N1CCCn1c[nH+]cc1)c1cccc(c1)[N+](=O)[O-]

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Molecular Weight: 422.4
Empirical Formula: C21H18N4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.507
Rotatable bonds: 6
H-donors: 1
H-acceptors: 6
PSA: 138
Number of rings: 4

     

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