| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 28th, 2009 | 27 | No |
Popular Name: (5Z)-3-benzyl-5-[(1,3-dimethyl-2-oxo-benzimidazol-5-yl)methylene]thiazolidine-2,4-dione (5Z)-3-benzyl-5-[(1,3-dimethyl-2…
| 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) | 2.39 | 10.1 | -14.23 | 0 | 6 | 0 | 66 | 379.441 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ENPP2-1-E | Autotaxin (cluster #1 Of 2), Eukaryotic | Eukaryotes | 111 | 0.36 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| ENPP2_HUMAN | Q13822 | Autotaxin, Human | 111 | 0.36 | Binding ≤ 1μM |
| ENPP2_HUMAN | Q13822 | Autotaxin, Human | 111 | 0.36 | Binding ≤ 10μM |
