| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 30 | Yes |
Popular Name: N-[2-(4-pyridylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl]-4-(trifluoromethyl)benzamide N-[2-(4-pyridylmethyl)-3,4-dihyd…
| 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) | 3.61 | 9.39 | -13.1 | 1 | 4 | 0 | 45 | 411.427 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 3.61 | 12 | -119.06 | 3 | 4 | 2 | 48 | 413.443 | 5 | ↓ |
