| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 17 | Yes |
Popular Name: (3S)-3-methyl-1-[[(3R)-3-propyl-3-piperidyl]methyl]piperidine (3S)-3-methyl-1-[[(3R)-3-propyl-…
| 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) | 2.84 | 8.4 | -108.08 | 3 | 2 | 2 | 21 | 240.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.84 | 7.09 | -32.09 | 2 | 2 | 1 | 16 | 239.427 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.84 | 6.64 | -36.3 | 2 | 2 | 1 | 20 | 239.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
