| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 16 | Yes |
Popular Name: (1R,2S)-2-(9-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)cyclopropanamine (1R,2S)-2-(9-bromo-3,4-dihydro-2…
| 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) | 2.14 | 4.51 | -50.09 | 3 | 3 | 1 | 46 | 285.161 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.14 | 4.19 | -5.53 | 2 | 3 | 0 | 44 | 284.153 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
