| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2010 | 19 | Yes |
Popular Name: N-[[(3S)-1-[2-(2-methylimidazol-1-yl)ethyl]-3-piperidyl]methyl]propan-2-amine 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) | 1.34 | 7.21 | -74.94 | 3 | 4 | 2 | 39 | 266.433 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 6.74 | -42.59 | 2 | 4 | 1 | 38 | 265.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.34 | 8.94 | -112.83 | 3 | 4 | 2 | 39 | 266.433 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.34 | 9.42 | -172.89 | 4 | 4 | 3 | 40 | 267.441 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
