| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 18 | Yes |
Popular Name: (2S)-2-(3,5-dihydro-2H-1,4-benzoxazepin-4-ylmethyl)cyclopentanone (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) | 2.06 | 8.15 | -36.55 | 1 | 3 | 1 | 31 | 246.33 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.06 | 6.22 | -8.31 | 0 | 3 | 0 | 30 | 245.322 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
