COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK084332
Chemical Name: methyl4-{[(2E,5Z)-5-(2-bromo-4-hydroxy-5-methoxybenzylidene)-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino}benzoate
Smiles: COC(=O)c1ccc(cc1)/N=C\1/S/C(=C\c2cc(OC)c(cc2Br)O)/C(=O)N1C

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Molecular Weight: 477.34
Empirical Formula: C20H17BrN2O5S

Physical State: Dry powder
Available Amount: 79 mg

Lipinsky:
logP: 5.429
Rotatable bonds: 4
H-donors: 1
H-acceptors: 5
PSA: 113
Number of rings: 3

     

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