| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 28th, 2011 | 15 | Yes |
Popular Name: 4-(1-Azepanyl)-2-methylaniline 4-(1-Azepanyl)-2-methylaniline
Find On: PubMed — Wikipedia — Google
CAS Numbers: 847455-22-5 , N/A , [847455-22-5]
| 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) | 3.31 | 6.75 | -27.72 | 3 | 2 | 1 | 30 | 205.325 | 1 | ↓ |
| Mid Mid (pH 6-8) | 3.31 | 6.43 | -2.98 | 2 | 2 | 0 | 29 | 204.317 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
