| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 18 | Yes |
Popular Name: (2S)-2-(4,4-diethyl-1-piperidyl)-2-[(3S)-tetrahydrofuran-3-yl]ethanamine (2S)-2-(4,4-diethyl-1-piperidyl)…
| 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) | 1.85 | 4.69 | -127.61 | 4 | 3 | 2 | 41 | 256.434 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 3.11 | -43.24 | 3 | 3 | 1 | 40 | 255.426 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 5.16 | -35.26 | 3 | 3 | 1 | 40 | 255.426 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
