COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK393838
Chemical Name: (4E)-2-(3,5-dichlorophenyl)-4-[3-ethoxy-4-(prop-2-yn-1-yloxy)benzylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCOc1cc(ccc1OCC#C)/C=C/1\C(=NN(C1=O)c1cc(Cl)cc(c1)Cl)C

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Molecular Weight: 429.3
Empirical Formula: C22H18Cl2N2O3

Physical State: Dry powder
Available Amount: 99 mg

Lipinsky:
logP: 4.912
Rotatable bonds: 5
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 3

     

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