COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL406815
Chemical Name: (4E)-4-(4-{2-[4-(butan-2-yl)phenoxy]ethoxy}-3-methoxybenzylidene)-5-hydroxy-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCC(c1ccc(cc1)OCCOc1ccc(cc1OC)/C=C/1\C(=NN(C1=O)c1ccccc1)O)C

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Molecular Weight: 486.57
Empirical Formula: C29H30N2O5

Physical State: Dry powder
Available Amount: 162 mg

Lipinsky:
logP: 6.557
Rotatable bonds: 8
H-donors: 1
H-acceptors: 5
PSA: 80
Number of rings: 4

     

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