| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: N-[(2,6-difluorophenyl)methyl]-3-(4-methylpiperazin-1-yl)propan-1-amine N-[(2,6-difluorophenyl)methyl]-3…
| 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) | 1.92 | 6.91 | -83.98 | 3 | 3 | 2 | 24 | 285.382 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.92 | 3.04 | -4.31 | 1 | 3 | 0 | 19 | 283.366 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 6.78 | -102.75 | 3 | 3 | 2 | 24 | 285.382 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.92 | 4.44 | -37.44 | 2 | 3 | 1 | 23 | 284.374 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
