COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK968411
Chemical Name: (2-bromo-6-ethoxy-4-{(Z)-[3-methyl-1-(4-methylphenyl)-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}phenoxy)acetonitrile
Smiles: N#CCOc1c(Br)cc(cc1OCC)/C=C\1/C(=NN(C1=O)c1ccc(cc1)C)C

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Molecular Weight: 454.32
Empirical Formula: C22H20BrN3O3

Available Amount: 0 mg

Lipinsky:
logP: 4.573
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 74
Number of rings: 3

     

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