| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 3rd, 2009 | 25 | Yes |
Popular Name: 2-[4-(2-cyanophenyl)-1-piperidyl]-N-(m-tolyl)acetamide 2-[4-(2-cyanophenyl)-1-piperidyl…
None
| 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 | 11.18 | -48.48 | 2 | 4 | 1 | 57 | 334.443 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 8.94 | -12.99 | 1 | 4 | 0 | 56 | 333.435 | 4 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DRD4-1-E | Dopamine D4 Receptor (cluster #1 Of 1), Eukaryotic | Eukaryotes | 8 | 0.45 | Functional ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| DRD4_HUMAN | P21917 | Dopamine D4 Receptor, Human | 8 | 0.45 | Functional ≤ 10μM |
| Description | Species |
|---|---|
| Dopamine receptors | |
| G alpha (i) signalling events |
