COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK995251
Chemical Name: 2-{(5Z)-5-[(1-methyl-1H-indol-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}-4-(methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C\c2cn(c3c2cccc3)C)/C1=O)C(=O)O

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Molecular Weight: 406.55
Empirical Formula: C18H18N2O3S3

Physical State: Dry powder
Available Amount: 350 mg

Lipinsky:
logP: 3.396
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 145
Number of rings: 3

     

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