UCSF

ZINC40918050

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2010 27 Yes

Popular Name: 3,5-diphenyl-1-[3-(trifluoromethyl)phenyl]pyrazole 3,5-diphenyl-1-[3-(trifluorometh…

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Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.09 13.28 -9.94 0 2 0 18 364.37 4 ↓

Activity (Go SEA)

Clustered Target Annotations
Code Description Organism Class Affinity (nM) LE (kcal/mol/atom) Type
F16P1-2-E Fructose-1,6-bisphosphatase 1 (cluster #2 Of 2), Eukaryotic Eukaryotes 6040 0.27 Binding ≤ 10μM
ChEMBL Target Annotations
Uniprot Swissprot Description Affinity (nM) LE (kcal/mol/atom) Type
F16P1_MOUSE Q9QXD6 Fructose-1,6-bisphosphatase 1, Mouse 6040 0.27 Binding ≤ 10μM

Reactome Annotations from Targets (via Uniprot)

Description Species
Gluconeogenesis

Analogs ( Draw Identity 99% 90% 80% 70% )