| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 21 | Yes |
Popular Name: 6-methyl-2-(1,3,4,5-tetrahydro-2-benzazepin-2-yl)pyridine-3-carboxamidine 6-methyl-2-(1,3,4,5-tetrahydro-2…
| 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) | 1.44 | 7.55 | -38.22 | 4 | 4 | 1 | 68 | 281.383 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.44 | 8.51 | -7.41 | 3 | 4 | 0 | 66 | 280.375 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.44 | 7.97 | -93.33 | 5 | 4 | 2 | 69 | 282.391 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
