COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK797591
Chemical Name: (5Z)-5-(4-fluorobenzylidene)-3-{3-[2-(methylsulfanyl)-1H-benzimidazol-1-yl]-3-oxopropyl}-2-thioxo-1,3-thiazolidin-4-one
Smiles: CSc1nc2c(n1C(=O)CCN1C(=S)S/C(=C\c3ccc(cc3)F)/C1=O)cccc2

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Molecular Weight: 457.57
Empirical Formula: C21H16FN3O2S3

Physical State: Dry powder
Available Amount: 397 mg

Lipinsky:
logP: 4.312
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 137
Number of rings: 4

     

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