COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL443417
Chemical Name: (4Z)-4-(4-bromobenzylidene)-5-hydroxy-2-(4-methylphenyl)-2,4-dihydro-3H-pyrazol-3-one
Smiles: Cc1ccc(cc1)N1N=C(/C(=C/c2ccc(cc2)Br)/C1=O)O

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Molecular Weight: 357.21
Empirical Formula: C17H13BrN2O2

Physical State: Dry powder
Available Amount: 94 mg

Lipinsky:
logP: 4.535
Rotatable bonds: 1
H-donors: 1
H-acceptors: 2
PSA: 52
Number of rings: 3

     

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