COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK566119
Chemical Name: (E)-{1-[2-(dimethylammonio)ethyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}(4-methylphenyl)methanolate
Smiles: Cc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CC[NH+](C)C)/[O-]

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Molecular Weight: 354.41
Empirical Formula: C20H22N2O4

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.925
Rotatable bonds: 4
H-donors: 1
H-acceptors: 4
PSA: 78
Number of rings: 3

     

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