| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 20 | Yes |
Popular Name: 1-[(3S)-2-(1-ethylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-3-yl]-N-methyl-methanamine 1-[(3S)-2-(1-ethylimidazol-2-yl)…
| 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) | 1.96 | 9.59 | -97.75 | 3 | 4 | 2 | 39 | 272.396 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.96 | 9.1 | -42.94 | 2 | 4 | 1 | 38 | 271.388 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
