COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK140170
Chemical Name: (4E)-4-[4-(diethylamino)benzylidene]-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: CCN(c1ccc(cc1)/C=C/1\C(=NN(C1=O)c1ccccc1)C)CC

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Molecular Weight: 333.43
Empirical Formula: C21H23N3O

Physical State: Dry powder
Available Amount: 910 mg

Lipinsky:
logP: 4.882
Rotatable bonds: 2
H-donors: 0
H-acceptors: 1
PSA: 35
Number of rings: 3

     

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