| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 19 | Yes |
Popular Name: (1S)-N-[(3-chloro-4-fluoro-phenyl)methyl]-1-[(3S)-1-methyl-3-piperidyl]ethanamine (1S)-N-[(3-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) | 3.40 | 8.12 | -37.87 | 2 | 2 | 1 | 16 | 285.814 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 6.86 | -47.93 | 2 | 2 | 1 | 20 | 285.814 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.40 | 9.34 | -109.07 | 3 | 2 | 2 | 21 | 286.822 | 4 | ↓ |
