| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 14 | Yes |
Popular Name: 1-[(3S,4R)-3-amino-4-methyl-1-piperidyl]-2-cyclopropyl-ethanone 1-[(3S,4R)-3-amino-4-methyl-1-pi…
| 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) | 0.55 | 3.88 | -45.3 | 3 | 3 | 1 | 48 | 197.302 | 2 | ↓ |
| Hi High (pH 8-9.5) | 0.55 | 3.62 | -7.78 | 2 | 3 | 0 | 46 | 196.294 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
