| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 9th, 2010 | 21 | No |
Popular Name: methyl methyl
| 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) | 3.40 | 9.15 | -18.46 | 0 | 3 | 0 | 43 | 347.263 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| Q7JHP9-1-E | Transporter (cluster #1 Of 1), Eukaryotic | Eukaryotes | 5 | 0.55 | Binding ≤ 10μM |
| SC6A4-1-E | Serotonin Transporter (cluster #1 Of 4), Eukaryotic | Eukaryotes | 120 | 0.46 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| SC6A4_MACMU | Q9MYX0 | Serotonin Transporter, Macmu | 120 | 0.46 | Binding ≤ 1μM |
| Q7JHP9_MACMU | Q7JHP9 | Transporter, Macmu | 5.3 | 0.55 | Binding ≤ 1μM |
| SC6A4_MACMU | Q9MYX0 | Serotonin Transporter, Macmu | 120 | 0.46 | Binding ≤ 10μM |
| Q7JHP9_MACMU | Q7JHP9 | Transporter, Macmu | 5.3 | 0.55 | Binding ≤ 10μM |
