COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL173001
Chemical Name: (4Z)-4-(1,3-benzodioxol-5-ylmethylidene)-2-(4-fluorophenyl)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Smiles: Fc1ccc(cc1)N1N=C(/C(=C/c2ccc3c(c2)OCO3)/C1=O)C

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Molecular Weight: 324.31
Empirical Formula: C18H13FN2O3

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 3.486
Rotatable bonds: 1
H-donors: 0
H-acceptors: 3
PSA: 51
Number of rings: 4

     

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