COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL558370
Chemical Name: ethyl2-[(4E)-4-{4-[(4-bromobenzyl)oxy]-3-methoxybenzylidene}-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Smiles: CCOC(=O)c1sc(nc1C)N1N=C(/C(=C\c2ccc(c(c2)OC)OCc2ccc(cc2)Br)/C1=O)C

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Molecular Weight: 570.46
Empirical Formula: C26H24BrN3O5S

Physical State: Dry powder
Available Amount: 30 mg

Lipinsky:
logP: 5.705
Rotatable bonds: 7
H-donors: 0
H-acceptors: 5
PSA: 118
Number of rings: 4

     

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