| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 18 | Yes |
Popular Name: (1R,2S)-2-(9-bromo-3,4-dihydro-2H-1,5-benzodioxepin-7-yl)cyclopropanecarboxylic (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) | 2.48 | 7.54 | -45.15 | 0 | 4 | -1 | 59 | 312.139 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.48 | 5.55 | -9.83 | 1 | 4 | 0 | 56 | 313.147 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
