COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK113638
Chemical Name: 3-{(5E)-4-oxo-5-[4-(pyrrolidin-1-yl)benzylidene]-2-thioxo-1,3-thiazolidin-3-yl}benzoicacid
Smiles: S=C1S/C(=C/c2ccc(cc2)N2CCCC2)/C(=O)N1c1cccc(c1)C(=O)O

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Molecular Weight: 410.52
Empirical Formula: C21H18N2O3S2

Physical State: Dry powder
Available Amount: 276 mg

Lipinsky:
logP: 4.727
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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