| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 9th, 2010 | 21 | Yes |
Popular Name: N-[[5-[(isopropylamino)methyl]-4-methyl-2-furyl]methyl]-N,1-dimethyl-piperidin-4-amine N-[[5-[(isopropylamino)methyl]-4…
| 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) | 2.27 | 9.66 | -163.95 | 4 | 4 | 3 | 39 | 296.479 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 7.17 | -79.38 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 7.26 | -88.94 | 3 | 4 | 2 | 37 | 295.471 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
