COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK378570
Chemical Name: 3-[(4E)-4-{[5-(4-methyl-2-nitrophenyl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoicacid
Smiles: Cc1ccc(c(c1)[N+](=O)[O-])c1ccc(o1)/C=C\1/C(=O)N(N=C1C(F)(F)F)c1cccc(c1)C(=O)O

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Molecular Weight: 485.38
Empirical Formula: C23H14F3N3O6

Physical State: Dry powder
Available Amount: 199 mg

Lipinsky:
logP: 6.66
Rotatable bonds: 4
H-donors: 1
H-acceptors: 6
PSA: 128
Number of rings: 4

     

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