| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 6th, 2011 | 20 | Yes |
Popular Name: 5-[(2S)-2-[2-(methylamino)ethyl]piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione 5-[(2S)-2-[2-(methylamino)ethyl]…
| 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) | -1.00 | 1.2 | -40.04 | 4 | 7 | 1 | 103 | 281.336 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.54 | -0.74 | -44.28 | 3 | 7 | 0 | 106 | 280.328 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
