| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | Yes |
Popular Name: N-[[1-(difluoromethyl)imidazol-2-yl]methyl]-3-[(2S)-2-methyl-1-piperidyl]propan-1-amine N-[[1-(difluoromethyl)imidazol-2…
| 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) | 1.75 | 6.82 | -35.35 | 2 | 4 | 1 | 34 | 287.378 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.75 | 8.14 | -103.14 | 3 | 4 | 2 | 39 | 288.386 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.75 | 8.53 | -194.81 | 4 | 4 | 3 | 40 | 289.394 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.75 | 7.17 | -79.29 | 3 | 4 | 2 | 36 | 288.386 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
