COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995280
Chemical Name: 4-{(5E)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}butanoicacid
Smiles: OC(=O)CCCN1C(=S)S/C(=C/c2cccn2C)/C1=O

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Molecular Weight: 310.4
Empirical Formula: C13H14N2O3S2

Physical State: Dry powder
Available Amount: 367 mg

Lipinsky:
logP: 0.883
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 119
Number of rings: 2

     

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