COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK622797
Chemical Name: 2-[(5E)-5-(2H-chromen-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioicacid
Smiles: OC(=O)CCC(N1C(=S)S/C(=C/C2=Cc3c(OC2)cccc3)/C1=O)C(=O)O

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Molecular Weight: 405.45
Empirical Formula: C18H15NO6S2

Physical State: Dry powder
Available Amount: 321 mg

Lipinsky:
logP: 1.305
Rotatable bonds: 8
H-donors: 2
H-acceptors: 6
PSA: 161
Number of rings: 3

     

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