COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK387662
Chemical Name: (2E,5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-2-[(4-ethoxyphenyl)imino]-3-ethyl-1,3-thiazolidin-4-one
Smiles: CCOc1ccc(cc1)/N=C\1/S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1CC

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Molecular Weight: 396.47
Empirical Formula: C21H20N2O4S

Physical State: Dry powder
Available Amount: 197 mg

Lipinsky:
logP: 5.447
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 85
Number of rings: 4

     

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