COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL022753
Chemical Name: 4-(methylsulfanyl)-2-[(5E)-4-oxo-2-thioxo-5-({5-[2-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-1,3-thiazolidin-3-yl]butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/c2ccc(o2)c2ccccc2C(F)(F)F)/C1=O)C(=O)O

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Molecular Weight: 487.54
Empirical Formula: C20H16F3NO4S3

Physical State: Dry powder
Available Amount: 60 mg

Lipinsky:
logP: 5.456
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 153
Number of rings: 3

     

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