COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK608861
Chemical Name: N-(1,1-dioxido-2,3-dihydrothiophen-3-yl)-6-[(5Z)-5-(furan-2-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanamide
Smiles: O=C(NC1C=CS(=O)(=O)C1)CCCCCN1C(=S)S/C(=C\c2ccco2)/C1=O

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Molecular Weight: 440.57
Empirical Formula: C18H20N2O5S3

Physical State: Dry powder
Available Amount: 342 mg

Lipinsky:
logP: 0.438
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 162
Number of rings: 3

     

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