| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2010 | 31 | No |
Popular Name: 6-(3,4-dimethoxyphenyl)-2-[[4-(morpholinomethyl)phenyl]methyl]-4,5-dihydropyridazin-3-one 6-(3,4-dimethoxyphenyl)-2-[[4-(m…
| 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) | 2.27 | 7.52 | -13.82 | 0 | 7 | 0 | 64 | 423.513 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 9.78 | -45.8 | 1 | 7 | 1 | 65 | 424.521 | 7 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PDE4D-1-E | Phosphodiesterase 4D (cluster #1 Of 2), Eukaryotic | Eukaryotes | 46 | 0.33 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| PDE4D_HUMAN | Q08499 | Phosphodiesterase 4D, Human | 45.9 | 0.33 | Binding ≤ 1μM |
| PDE4D_HUMAN | Q08499 | Phosphodiesterase 4D, Human | 45.9 | 0.33 | Binding ≤ 10μM |
| Description | Species |
|---|---|
| DARPP-32 events | |
| G alpha (s) signalling events |
