COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK601326
Chemical Name: (4E)-4-[(4-chlorophenyl)(hydroxy)methylidene]-1-(1,1-dioxidotetrahydrothiophen-3-yl)-5-(pyridin-3-yl)pyrrolidine-2,3-dione
Smiles: Clc1ccc(cc1)/C(=C/1\C(=O)C(=O)N(C1c1cccnc1)C1CCS(=O)(=O)C1)/O

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Molecular Weight: 432.88
Empirical Formula: C20H17ClN2O5S

Physical State: Dry powder
Available Amount: 311 mg

Lipinsky:
logP: 1.094
Rotatable bonds: 3
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 4

     

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