| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 19 | Yes |
Popular Name: 2-methyl-2-(methylamino)-1-[4-[[(2S)-tetrahydrofuran-2-yl]methyl]piperazin-1-yl]propan-1-one 2-methyl-2-(methylamino)-1-[4-[[…
| 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) | 0.52 | 2.33 | -42.05 | 2 | 5 | 1 | 49 | 270.397 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.52 | 2.35 | -7.21 | 1 | 5 | 0 | 45 | 269.389 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.52 | 4.43 | -90.05 | 3 | 5 | 2 | 51 | 271.405 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
