| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 11 | No |
Popular Name: 3-(azepan-1-yl)propanal 3-(azepan-1-yl)propanal
| 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) | 1.85 | 5.72 | -39.48 | 1 | 2 | 1 | 22 | 156.249 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 3.64 | -5.38 | 0 | 2 | 0 | 20 | 155.241 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | US4820695 | IBM Patent Data |
