| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 18th, 2011 | 25 | Yes |
Popular Name: 1-(7,8-dimethoxy-1,2,4,5-tetrahydro-3-benzazepin-3-yl)-3-(4-pyridyl)propan-1-one 1-(7,8-dimethoxy-1,2,4,5-tetrahy…
| 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) | 2.12 | 8.55 | -13.82 | 0 | 5 | 0 | 52 | 340.423 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.12 | 9.01 | -46.54 | 1 | 5 | 1 | 53 | 341.431 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
