COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL035643
Chemical Name: 2-[(5E)-5-(1H-benzimidazol-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-(methylsulfanyl)butanoicacid
Smiles: CSCCC(N1C(=S)S/C(=C/c2nc3c([nH]2)cccc3)/C1=O)C(=O)O

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Molecular Weight: 393.51
Empirical Formula: C16H15N3O3S3

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 2.548
Rotatable bonds: 6
H-donors: 2
H-acceptors: 3
PSA: 168
Number of rings: 3

     

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