| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2011 | 21 | Yes |
Popular Name: 2-amino-1-[(3S)-3-[2-(4-fluorophenyl)ethyl]-1-piperidyl]-2-methyl-propan-1-one 2-amino-1-[(3S)-3-[2-(4-fluoroph…
| 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) | 3.14 | 6.89 | -42.64 | 3 | 3 | 1 | 48 | 293.406 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 7.38 | -8.76 | 2 | 3 | 0 | 46 | 292.398 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
