| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 12th, 2010 | 20 | Yes |
Popular Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(1-piperidyl)propan-1-one 3-(3,4-dihydro-1H-isoquinolin-2-…
| 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) | 2.26 | 9.75 | -42.73 | 1 | 3 | 1 | 25 | 273.4 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.26 | 7.48 | -7.77 | 0 | 3 | 0 | 24 | 272.392 | 3 | ↓ |
