| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 20 | Yes |
Popular Name: N-[(2,4-difluorophenyl)methyl]-3-(4-methylpiperazin-1-yl)propan-1-amine N-[(2,4-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) | 1.94 | 6.99 | -93.12 | 3 | 3 | 2 | 24 | 285.382 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 6.86 | -112.55 | 3 | 3 | 2 | 24 | 285.382 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.94 | 4.52 | -45.47 | 2 | 3 | 1 | 23 | 284.374 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
