| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: N-methyl-1-[5-(1,3,4,5-tetrahydro-2-benzazepin-2-ylmethyl)isoxazol-3-yl]methanamine N-methyl-1-[5-(1,3,4,5-tetrahydr…
| 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) | 2.17 | 8.03 | -98.66 | 3 | 4 | 2 | 47 | 273.38 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 5.94 | -42.4 | 2 | 4 | 1 | 46 | 272.372 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
