COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK037430
Chemical Name: (1E)-1-(4-ethoxy-4-oxobutan-2-ylidene)-3,5,5-trimethyl-4,5-dihydro-1H-pyrazol-1-ium
Smiles: CCOC(=O)C/C(=[N+]\1/N=C(CC1(C)C)C)/C

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Molecular Weight: 225.31
Empirical Formula: C12H21N2O2

Available Amount: 0 mg

Lipinsky:
logP: 0
Rotatable bonds: 4
H-donors: 0
H-acceptors: 2
PSA: 41
Number of rings: 1

     

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