COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL378664
Chemical Name: ethyl2-[(4E)-4-({5-[4-chloro-3-(trifluoromethyl)phenyl]furan-2-yl}methylidene)-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(o2)c2ccc(c(c2)C(F)(F)F)Cl)/C1=O)C

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Molecular Weight: 523.92
Empirical Formula: C23H17ClF3N3O4S

Physical State: Dry powder
Available Amount: 868 mg

Lipinsky:
logP: 6.543
Rotatable bonds: 5
H-donors: 0
H-acceptors: 4
PSA: 113
Number of rings: 4

     

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