| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 20 | Yes |
Popular Name: 1-(3-methylbut-2-enyl)-N-[(1S)-1-(3-pyridyl)ethyl]piperidin-4-amine 1-(3-methylbut-2-enyl)-N-[(1S)-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) | 2.92 | 7.83 | -34.91 | 2 | 3 | 1 | 29 | 274.432 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.92 | 6.66 | -39.92 | 2 | 3 | 1 | 33 | 274.432 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
