| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 17 | Yes |
Popular Name: (2S)-N-[(4-chlorophenyl)methyl]piperidine-2-carboxamide (2S)-N-[(4-chlorophenyl)methyl]p…
| 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) | 2.17 | 5.07 | -39.72 | 3 | 3 | 1 | 46 | 253.753 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.17 | 3.78 | -8.14 | 2 | 3 | 0 | 41 | 252.745 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0826673A1; US5972946 | IBM Patent Data |
