COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK631133
Chemical Name: 2-{(5E)-5-[(2-methyl-2H-chromen-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/C2=Cc3ccccc3OC2C)/C1=O)C(=O)O

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Molecular Weight: 421.56
Empirical Formula: C19H19NO4S3

Physical State: Dry powder
Available Amount: 332 mg

Lipinsky:
logP: 3.604
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 149
Number of rings: 3

     

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