| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 15th, 2010 | 18 | Yes |
Popular Name: 5-[4-(aminomethyl)piperidine-1-carbonyl]-1H-pyrimidine-2,4-dione 5-[4-(aminomethyl)piperidine-1-c…
| 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) | -2.37 | -1.16 | -67.72 | 5 | 7 | 1 | 114 | 253.282 | 2 | ↓ |
| Hi High (pH 8-9.5) | -1.91 | -3.89 | -95.93 | 4 | 7 | 0 | 117 | 252.274 | 2 | ↓ |
| Mid Mid (pH 6-8) | -1.91 | -3.07 | -76.39 | 4 | 7 | 0 | 117 | 252.274 | 2 | ↓ |
