COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL149762
Chemical Name: (E)-(3-chloro-4-ethoxyphenyl){1-[3-(dimethylammonio)propyl]-2-[4-(methoxycarbonyl)phenyl]-4,5-dioxopyrrolidin-3-ylidene}methanolate
Smiles: CCOc1ccc(cc1Cl)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(=O)OC)CCC[NH+](C)C)/[O-]

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Molecular Weight: 500.98
Empirical Formula: C26H29ClN2O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.437
Rotatable bonds: 8
H-donors: 1
H-acceptors: 6
PSA: 100
Number of rings: 3

     

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