| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 20 | Yes |
Popular Name: [6-methyl-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)-3-pyridyl]methanamine [6-methyl-2-(1,3,4,5-tetrahydro-…
| 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) | 2.24 | 8.3 | -105.02 | 4 | 3 | 2 | 45 | 269.392 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 7.44 | -5.91 | 2 | 3 | 0 | 42 | 267.376 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.24 | 8 | -24.17 | 3 | 3 | 1 | 43 | 268.384 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.24 | 7.88 | -51.59 | 3 | 3 | 1 | 44 | 268.384 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
