| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 29th, 2010 | 14 | Yes |
Popular Name: 2-[(1S,3aR,6aS)-1-(aminomethyl)-3,3a,4,5,6,6a-hexahydro-2H-pentalen-1-yl]acetic 2-[(1S,3aR,6aS)-1-(aminomethyl)-…
| 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) | 0.76 | 4.63 | -49.63 | 3 | 3 | 0 | 68 | 197.278 | 3 | ↓ |
| Code | Description | Organism Class | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| O77773-1-E | Voltage-dependent Calcium Channel Alpha2delta Subunit (cluster #1 Of 1), Eukaryotic | Eukaryotes | 7181 | 0.51 | Binding ≤ 10μM |
| Uniprot | Swissprot | Description | Affinity (nM) | LE (kcal/mol/atom) | Type |
|---|---|---|---|---|---|
| O77773_PIG | O77773 | Voltage-dependent Calcium Channel Alpha2delta Subunit, Pig | 7181 | 0.51 | Binding ≤ 10μM |
