| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 15 | Yes |
Popular Name: (3S,5R)-3,5-dimethyl-1-[(3S,6S)-6-methyl-3-piperidyl]piperidine (3S,5R)-3,5-dimethyl-1-[(3S,6S)-…
| 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) | 2.47 | 7.18 | -105.92 | 3 | 2 | 2 | 21 | 212.381 | 1 | ↓ |
| Hi High (pH 8-9.5) | 2.47 | 4.76 | -35.42 | 2 | 2 | 1 | 20 | 211.373 | 1 | ↓ |
| Mid Mid (pH 6-8) | 2.47 | 5.91 | -30.63 | 2 | 2 | 1 | 16 | 211.373 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
