| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 20 | No |
Popular Name: [5-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)-2-pyridyl]hydrazine [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) | 1.36 | 3.89 | -8.38 | 3 | 5 | 0 | 63 | 270.336 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 5.98 | -41.31 | 4 | 5 | 1 | 65 | 271.344 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.36 | 4.37 | -32.42 | 4 | 5 | 1 | 65 | 271.344 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.36 | 6.46 | -101.07 | 5 | 5 | 2 | 66 | 272.352 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
