| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 19th, 2011 | 19 | Yes |
Popular Name: 1-[(3S,6S)-6-methyl-3-piperidyl]-4-phenyl-piperazine 1-[(3S,6S)-6-methyl-3-piperidyl]…
| 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) | 2.44 | 5.63 | -38.15 | 2 | 3 | 1 | 23 | 260.405 | 2 | ↓ |
| Hi High (pH 8-9.5) | 2.44 | 4.38 | -2.6 | 1 | 3 | 0 | 19 | 259.397 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.44 | 8.02 | -114.23 | 3 | 3 | 2 | 24 | 261.413 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.44 | 6.74 | -36.9 | 2 | 3 | 1 | 20 | 260.405 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
