| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: (2R)-2-(9-chloro-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-pyrrolidin-1-yl-ethanamine (2R)-2-(9-chloro-3,4-dihydro-2H-…
| 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) | 1.71 | 6.04 | -128.83 | 4 | 4 | 2 | 51 | 298.814 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.71 | 5.68 | -38.38 | 3 | 4 | 1 | 49 | 297.806 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.71 | 3.93 | -51.81 | 3 | 4 | 1 | 49 | 297.806 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
