COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443351
Chemical Name: (5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-{[(4-bromo-2-methylphenyl)amino]methyl}-1,3-thiazolidine-2,4-dione
Smiles: Brc1ccc(c(c1)C)NCN1C(=O)S/C(=C\c2ccc3c(c2)OCO3)/C1=O

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Molecular Weight: 447.31
Empirical Formula: C19H15BrN2O4S

Physical State: Dry powder
Available Amount: 420 mg

Lipinsky:
logP: 5.335
Rotatable bonds: 3
H-donors: 1
H-acceptors: 4
PSA: 93
Number of rings: 4

     

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