COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK618823
Chemical Name: 2-[(5E)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]acetamide
Smiles: O=C(CN1C(=S)S/C(=C/c2ccc3c(c2)OCO3)/C1=O)NCCCN1CCCC1=O

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Molecular Weight: 447.54
Empirical Formula: C20H21N3O5S2

Physical State: Dry powder
Available Amount: 339 mg

Lipinsky:
logP: 0.942
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 145
Number of rings: 4

     

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