| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 7th, 2010 | 29 | Yes |
Popular Name: N-[5-[(3-fluoro-4-methyl-phenyl)methyl]thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxy-benzamide N-[5-[(3-fluoro-4-methyl-phenyl)…
| 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) | 3.64 | 7.46 | -22.31 | 2 | 6 | 0 | 81 | 416.474 | 8 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACOD-1-E | Acyl-CoA Desaturase (cluster #1 Of 1), Eukaryotic | Eukaryotes | 82 | 0.34 | Binding ≤ 10μM |
| ACOD1-1-E | Acyl-CoA Desaturase 1 (cluster #1 Of 1), Eukaryotic | Eukaryotes | 22 | 0.37 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ACOD_HUMAN | O00767 | Acyl-CoA Desaturase, Human | 639 | 0.30 | Binding ≤ 1μM |
| ACOD1_MOUSE | P13516 | Acyl-CoA Desaturase 1, Mouse | 22 | 0.37 | Binding ≤ 1μM |
| ACOD_HUMAN | O00767 | Acyl-CoA Desaturase, Human | 639 | 0.30 | Binding ≤ 10μM |
| ACOD1_MOUSE | P13516 | Acyl-CoA Desaturase 1, Mouse | 22 | 0.37 | Binding ≤ 10μM |
