| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: N-[[3-[2-(azepan-1-yl)ethoxy]phenyl]methyl]propan-2-amine N-[[3-[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) | 3.64 | 9.92 | -82.78 | 3 | 3 | 2 | 30 | 292.467 | 7 | ↓ |
| Hi High (pH 8-9.5) | 3.64 | 8.01 | -35.74 | 2 | 3 | 1 | 29 | 291.459 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
