In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2011 | 13 | Yes |
Popular Name: (2R,5S)-2-methyl-5-(2-methylimidazol-1-yl)piperidine (2R,5S)-2-methyl-5-(2-methylimid…
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) | 0.59 | 5.56 | -90.81 | 3 | 3 | 2 | 36 | 181.283 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.59 | 5.08 | -42.95 | 2 | 3 | 1 | 34 | 180.275 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.