| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 20 | Yes |
Popular Name: [5-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1,3-dimethyl-pyrazol-4-yl]methanamine [5-(3,5-dihydro-2H-1,4-benzoxaze…
| 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) | 1.22 | 5.33 | -51.85 | 3 | 5 | 1 | 58 | 273.36 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.22 | 4.93 | -6.98 | 2 | 5 | 0 | 56 | 272.352 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.22 | 5.47 | -106.72 | 4 | 5 | 2 | 59 | 274.368 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
