| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 1st, 2008 | 15 | Yes |
Popular Name: [2-(azepan-1-yl)pyridin-4-yl]methanamine [2-(azepan-1-yl)pyridin-4-yl]met…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1303890-43-8 , 950444-83-4
| 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) | 1.69 | 3.49 | -28.21 | 3 | 3 | 1 | 43 | 206.313 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 4.91 | -4.51 | 2 | 3 | 0 | 42 | 205.305 | 2 | ↓ |
| Mid Mid (pH 6-8) | 1.69 | 3.65 | -49.28 | 3 | 3 | 1 | 44 | 206.313 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 243 - 245 | Enamine Building Blocks |
| MP | 243...245 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
