| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 22nd, 2011 | 19 | Yes |
Popular Name: [(3R)-3-(3,5-dihydro-2H-1,4-benzoxazepin-4-yl)-1-methyl-pyrrolidin-3-yl]methanamine [(3R)-3-(3,5-dihydro-2H-1,4-benz…
| 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) | 0.64 | 1.1 | -49.88 | 3 | 4 | 1 | 43 | 262.377 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 3.25 | -35.41 | 3 | 4 | 1 | 43 | 262.377 | 2 | ↓ |
| Mid Mid (pH 6-8) | 0.64 | 3.59 | -123.06 | 4 | 4 | 2 | 45 | 263.385 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
