| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: 2-[(6-bromo-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-methyl-pyrazol-3-amine 2-[(6-bromo-3,4-dihydro-2H-1,5-b…
| 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) | 2.68 | 6.26 | -10.13 | 2 | 5 | 0 | 62 | 338.205 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 6.44 | -36.12 | 3 | 5 | 1 | 64 | 339.213 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
