COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK740838
Chemical Name: 6-[(5E)-5-(2,3-dihydro-1,4-benzodioxin-6-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]hexanoicacid
Smiles: OC(=O)CCCCCN1C(=S)S/C(=C/c2ccc3c(c2)OCCO3)/C1=O

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Molecular Weight: 393.48
Empirical Formula: C18H19NO5S2

Physical State: Dry powder
Available Amount: 360 mg

Lipinsky:
logP: 2.177
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 133
Number of rings: 3

     

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