| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: [(3S)-3-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)quinuclidin-3-yl]methanamine [(3S)-3-(1,3,4,5-tetrahydro-2-be…
| 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) | 1.78 | 3.49 | -43.19 | 3 | 3 | 1 | 34 | 286.443 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 5.55 | -36.03 | 3 | 3 | 1 | 34 | 286.443 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.78 | 5.94 | -114.3 | 4 | 3 | 2 | 35 | 287.451 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
