| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| June 4th, 2013 | 25 | Yes |
Popular Name: (2S)-2-amino-1-[4-[1-(2-methoxyethyl)imidazol-2-yl]-1-piperidyl]-2-phenyl-ethanone (2S)-2-amino-1-[4-[1-(2-methoxye…
| 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) | -1.08 | 6.3 | -39.97 | 3 | 6 | 1 | 75 | 343.451 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.08 | 6.64 | -94.07 | 4 | 6 | 2 | 76 | 344.459 | 6 | ↓ |
| Mid Mid (pH 6-8) | -1.08 | 5.83 | -12.21 | 2 | 6 | 0 | 73 | 342.443 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.