| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 18 | Yes |
Popular Name: (2R)-2-(4-bromophenyl)-2-[(3R,5S)-3,5-dimethyl-1-piperidyl]ethanamine (2R)-2-(4-bromophenyl)-2-[(3R,5S…
| 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) | 3.16 | 8.06 | -133.28 | 4 | 2 | 2 | 32 | 313.283 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.95 | -33.53 | 3 | 2 | 1 | 30 | 312.275 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 6.3 | -51.04 | 3 | 2 | 1 | 31 | 312.275 | 3 | ↓ |
