| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 19 | No |
Popular Name: 1-(1,2,3,4-tetrahydroisoquinolin-7-yl)azepane-2,7-dione 1-(1,2,3,4-tetrahydroisoquinolin…
| 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) | 0.28 | 4.84 | -13.36 | 1 | 4 | 0 | 49 | 258.321 | 1 | ↓ |
| Mid Mid (pH 6-8) | 0.28 | 6.2 | -48.81 | 2 | 4 | 1 | 54 | 259.329 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
