COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK608297
Chemical Name: 4-[5-(1,3-benzodioxol-5-yl)-3-(6-chloro-2-hydroxy-4-phenylquinolin-3-yl)-4,5-dihydro-1H-pyrazol-1-yl]-4-oxobutanoicacid
Smiles: OC(=O)CCC(=O)N1N=C(CC1c1ccc2c(c1)OCO2)c1c(O)nc2c(c1c1ccccc1)cc(cc2)Cl

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Molecular Weight: 543.96
Empirical Formula: C29H22ClN3O6

Physical State: Dry powder
Available Amount: 301 mg

Lipinsky:
logP: 3.558
Rotatable bonds: 7
H-donors: 2
H-acceptors: 6
PSA: 121
Number of rings: 6

     

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