COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL371646
Chemical Name: ethyl2-[(4E)-4-(2-ethoxybenzylidene)-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\c2ccccc2OCC)/C1=O)C

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Molecular Weight: 399.47
Empirical Formula: C20H21N3O4S

Physical State: Dry powder
Available Amount: 523 mg

Lipinsky:
logP: 3.988
Rotatable bonds: 6
H-donors: 0
H-acceptors: 4
PSA: 109
Number of rings: 3

     

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