| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 18 | Yes |
Popular Name: (3S)-3-[[(2S)-2-(1-piperidyl)propyl]amino]azepan-2-one (3S)-3-[[(2S)-2-(1-piperidyl)pro…
| 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) | 1.37 | 5.37 | -41.76 | 3 | 4 | 1 | 46 | 254.398 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 1.37 | 5.73 | -118.65 | 4 | 4 | 2 | 50 | 255.406 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
