COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK219823
Chemical Name: 4-[(4E)-4-{[5-(1,3-dioxo-2,3-dihydro-1H-isoindol-5-yl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: OC(=O)c1ccc(cc1)N1N=C(/C(=C\c2ccc(o2)c2ccc3c(c2)C(=O)NC3=O)/C1=O)C(F)(F)F

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Molecular Weight: 495.37
Empirical Formula: C24H12F3N3O6

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 5.646
Rotatable bonds: 3
H-donors: 2
H-acceptors: 6
PSA: 129
Number of rings: 5

     

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