| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2008 | 21 | Yes |
Popular Name: 2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-1H-pyrimidin-4-one 2-[2-(3,4-dihydro-1H-isoquinolin…
None
| 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) | 2.13 | 4.23 | -50.85 | 0 | 5 | -1 | 69 | 300.363 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 6.31 | -13.73 | 1 | 5 | 0 | 66 | 301.371 | 3 | ↓ |
