| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: [(1S,2R,4R)-4-methyl-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)cyclohexyl]methanamine [(1S,2R,4R)-4-methyl-2-(1,3,4,5-…
| 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) | 2.83 | 7.29 | -43.52 | 3 | 2 | 1 | 31 | 273.444 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 8.78 | -113.22 | 4 | 2 | 2 | 32 | 274.452 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
