COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK120348
Chemical Name: (2E,5Z)-5-(3-bromo-4-hydroxybenzylidene)-3-(2-ethoxyethyl)-2-(phenylimino)-1,3-thiazolidin-4-one
Smiles: CCOCCN1/C(=N\c2ccccc2)/S/C(=C\c2ccc(c(c2)Br)O)/C1=O

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Molecular Weight: 447.35
Empirical Formula: C20H19BrN2O3S

Physical State: Dry powder
Available Amount: 361 mg

Lipinsky:
logP: 5.498
Rotatable bonds: 6
H-donors: 1
H-acceptors: 3
PSA: 87
Number of rings: 3

     

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