| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2010 | 26 | Yes |
Popular Name: (2S)-2-(4-methylsulfonylphenyl)-3-tetrahydropyran-4-yl-N-thiazol-2-yl-propanamide (2S)-2-(4-methylsulfonylphenyl)-…
| 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) | 2.32 | 5.26 | -21.54 | 1 | 6 | 0 | 85 | 394.518 | 6 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HXK4-1-E | Hexokinase Type IV (cluster #1 Of 1), Eukaryotic | Eukaryotes | 8930 | 0.27 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| HXK4_HUMAN | P35557 | Hexokinase Type IV, Human | 1690 | 0.31 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| Glucose transport | |
| Regulation of gene expression in beta cells | |
| Regulation of Glucokinase by Glucokinase Regulatory Protein |
