COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK565702
Chemical Name: (E)-1-benzofuran-2-yl{1-[2-(dimethylammonio)ethyl]-4,5-dioxo-2-(thiophen-2-yl)pyrrolidin-3-ylidene}methanolate
Smiles: C[NH+](CCN1C(c2cccs2)/C(=C(/c2cc3c(o2)cccc3)\[O-])/C(=O)C1=O)C

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Molecular Weight: 396.47
Empirical Formula: C21H20N2O4S

Physical State: Dry powder
Available Amount: 306 mg

Lipinsky:
logP: 3.433
Rotatable bonds: 5
H-donors: 1
H-acceptors: 4
PSA: 106
Number of rings: 4

     

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