| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 20th, 2010 | 18 | Yes |
Popular Name: 4-Phenyl-2-pyrrolidin-1-ylmethyl-piperidine 4-Phenyl-2-pyrrolidin-1-ylmethyl…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 885951-15-5 , [885951-15-5]
| 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) | 2.99 | 9.08 | -116.43 | 3 | 2 | 2 | 21 | 246.398 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.99 | 6.94 | -41.12 | 2 | 2 | 1 | 20 | 245.39 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.99 | 7.81 | -33.38 | 2 | 2 | 1 | 16 | 245.39 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0330461A2; US5114945 | IBM Patent Data |
