| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: N-[[2-[2-(azepan-1-yl)ethoxy]phenyl]methyl]propan-1-amine N-[[2-[2-(azepan-1-yl)ethoxy]phe…
| 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) | 3.83 | 10.21 | -98.16 | 3 | 3 | 2 | 30 | 292.467 | 8 | ↓ |
| Hi High (pH 8-9.5) | 3.83 | 8.29 | -34.09 | 2 | 3 | 1 | 29 | 291.459 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
