| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 19 | Yes |
Popular Name: (2R)-N-[(2-chloro-4-fluoro-phenyl)methyl]-2-(1-piperidyl)propan-1-amine (2R)-N-[(2-chloro-4-fluoro-pheny…
| 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) | 3.53 | 9.55 | -116.93 | 3 | 2 | 2 | 21 | 286.822 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 7.67 | -40.08 | 2 | 2 | 1 | 20 | 285.814 | 5 | ↓ |
| Mid Mid (pH 6-8) | 3.53 | 8.27 | -30.94 | 2 | 2 | 1 | 16 | 285.814 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
