COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK563440
Chemical Name: (E)-(3-chloro-4-ethoxyphenyl){1-[2-(dimethylammonio)ethyl]-2-(furan-2-yl)-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccco1)CC[NH+](C)C)/[O-]

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Molecular Weight: 418.88
Empirical Formula: C21H23ClN2O5

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.496
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 87
Number of rings: 3

     

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