COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK534650
Chemical Name: 4-[3-(6-bromo-2-oxo-4-phenyl-1,2-dihydroquinolin-3-yl)-5-(3-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1cccc(c1)[N+](=O)[O-])c1c(=O)[nH]c2c(c1c1ccccc1)cc(cc2)Br

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Molecular Weight: 589.4
Empirical Formula: C28H21BrN4O6

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.705
Rotatable bonds: 6
H-donors: 2
H-acceptors: 6
PSA: 144
Number of rings: 5

     

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