| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 14th, 2010 | 18 | Yes |
Popular Name: 2-(4-ethylpiperazin-1-yl)-1-[(3S)-3-methyl-1-piperidyl]ethanone 2-(4-ethylpiperazin-1-yl)-1-[(3S…
| 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) | 1.11 | 5.9 | -35.55 | 1 | 4 | 1 | 28 | 254.398 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.11 | 3.62 | -7.6 | 0 | 4 | 0 | 27 | 253.39 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
