| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 18 | Yes |
Popular Name: (3S,5R)-3,5-dimethyl-1-[[(3S)-3-propyl-3-piperidyl]methyl]piperidine (3S,5R)-3,5-dimethyl-1-[[(3S)-3-…
| 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) | 3.31 | 9.07 | -97.58 | 3 | 2 | 2 | 21 | 254.462 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 7.3 | -37.42 | 2 | 2 | 1 | 20 | 253.454 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.31 | 7.74 | -32.41 | 2 | 2 | 1 | 16 | 253.454 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
