| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 18 | Yes |
Popular Name: N-[[(3S)-1-[2-(2-methylimidazol-1-yl)ethyl]-3-piperidyl]methyl]ethanamine N-[[(3S)-1-[2-(2-methylimidazol-…
| 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) | 0.70 | 6.67 | -75.88 | 3 | 4 | 2 | 39 | 252.406 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 6.19 | -43.73 | 2 | 4 | 1 | 38 | 251.398 | 6 | ↓ |
| Mid Mid (pH 6-8) | 0.70 | 8.42 | -113.27 | 3 | 4 | 2 | 39 | 252.406 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 0.70 | 8.88 | -172.73 | 4 | 4 | 3 | 40 | 253.414 | 6 | ↓ |
