| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 4th, 2011 | 20 | Yes |
Popular Name: (2S)-2-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-2-pyrimidin-4-yl-ethanamine (2S)-2-(3,5-dihydro-2H-1,4-benzo…
| 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) | 0.31 | 4.14 | -54.34 | 3 | 5 | 1 | 66 | 271.344 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | 3.74 | -6.77 | 2 | 5 | 0 | 64 | 270.336 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
