COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL431152
Chemical Name: 3-{(4Z)-4-[3-bromo-4-(diethylamino)benzylidene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}benzoicacid
Smiles: CCN(c1ccc(cc1Br)/C=C\1/C(=NN(C1=O)c1cccc(c1)C(=O)O)C)CC

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Molecular Weight: 456.34
Empirical Formula: C22H22BrN3O3

Physical State: Dry powder
Available Amount: 76 mg

Lipinsky:
logP: 5.751
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 73
Number of rings: 3

     

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