| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2010 | 13 | Yes |
Popular Name: 2-(2-pyridinyl)azepane 2-(2-pyridinyl)azepane
Find On: PubMed — Wikipedia — Google
CAS Number: 383128-97-0
| 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) | 1.92 | 3.69 | -3.25 | 1 | 2 | 0 | 25 | 176.263 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 1.92 | 4.31 | -28.58 | 2 | 2 | 1 | 26 | 177.271 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | WO1993015059A1 | IBM Patent Data |
