| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 20 | Yes |
Popular Name: 2-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-4-methyl-pyrazol-3-amine 2-[(6-chloro-3,4-dihydro-2H-1,5-…
| 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) | 2.55 | 6.15 | -10.29 | 2 | 5 | 0 | 62 | 293.754 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.55 | 6.32 | -36.39 | 3 | 5 | 1 | 64 | 294.762 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
