| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: N-[[2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)-4-pyridyl]methyl]ethanamine N-[[2-(1,3,4,5-tetrahydro-2-benz…
| 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) | 2.94 | 9.9 | -44.32 | 2 | 3 | 1 | 33 | 282.411 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 8.53 | -5.16 | 1 | 3 | 0 | 28 | 281.403 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.94 | 8.87 | -29.17 | 2 | 3 | 1 | 29 | 282.411 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
