COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL039990
Chemical Name: methyl4-[(3E)-3-[hydroxy(4-methoxyphenyl)methylidene]-4,5-dioxo-1-(tetrahydrofuran-2-ylmethyl)pyrrolidin-2-yl]benzoate
Smiles: COc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1ccc(cc1)C(=O)OC)CC1CCCO1)/O

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Molecular Weight: 451.48
Empirical Formula: C25H25NO7

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.078
Rotatable bonds: 4
H-donors: 1
H-acceptors: 7
PSA: 102
Number of rings: 4

     

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