COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK957930
Chemical Name: (4E)-4-[2-bromo-5-ethoxy-4-(prop-2-en-1-yloxy)benzylidene]-2-(3,4-dichlorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: C=CCOc1cc(Br)c(cc1OCC)/C=C/1\C(=NN(C1=O)c1ccc(c(c1)Cl)Cl)C

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Molecular Weight: 510.21
Empirical Formula: C22H19BrCl2N2O3

Physical State: Dry powder
Available Amount: 44 mg

Lipinsky:
logP: 6.694
Rotatable bonds: 6
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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