COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK112286
Chemical Name: (4E)-4-[4-ethoxy-2-methyl-5-(propan-2-yl)benzylidene]-2-phenyl-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCCC1=NN(C(=O)/C/1=C/c1cc(C(C)C)c(cc1C)OCC)c1ccccc1

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Molecular Weight: 390.53
Empirical Formula: C25H30N2O2

Physical State: Dry powder
Available Amount: 314 mg

Lipinsky:
logP: 6.652
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 3

     

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