| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 17 | Yes |
Popular Name: N-[(5-iodo-2-furyl)methyl]-3-(1-piperidyl)propan-1-amine N-[(5-iodo-2-furyl)methyl]-3-(1-…
| 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) | 3.17 | 8.54 | -108.97 | 3 | 3 | 2 | 34 | 350.244 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.17 | 7.17 | -35.36 | 2 | 3 | 1 | 30 | 349.236 | 6 | ↓ |
| Mid Mid (pH 6-8) | 3.17 | 6.32 | -43.2 | 2 | 3 | 1 | 33 | 349.236 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
