| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 4th, 2010 | 13 | Yes |
Popular Name: 2-(1-pyrrolidinylmethyl)azepane 2-(1-pyrrolidinylmethyl)azepane
Find On: PubMed — Wikipedia — Google
CAS Number: 112282-41-4
| 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) | 1.93 | 6.42 | -111.14 | 3 | 2 | 2 | 21 | 184.327 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 5.38 | -29.36 | 2 | 2 | 1 | 16 | 183.319 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 4.6 | -31.14 | 2 | 2 | 1 | 20 | 183.319 | 2 | ↓ |
