| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 19 | Yes |
Popular Name: (2S)-2-ethyl-1-(2-methoxyethyl)-4-[[(2S)-tetrahydropyran-2-yl]methyl]piperazine (2S)-2-ethyl-1-(2-methoxyethyl)-…
| 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) | 1.96 | 5.02 | -31.95 | 1 | 4 | 1 | 26 | 271.425 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 2.69 | -3.6 | 0 | 4 | 0 | 25 | 270.417 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.96 | 4.91 | -29.78 | 1 | 4 | 1 | 26 | 271.425 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
