| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 10th, 2010 | 19 | Yes |
Popular Name: (1S,2S)-2-[4-[(1R)-1-methylpropyl]piperazin-1-yl]cyclooctanamine (1S,2S)-2-[4-[(1R)-1-methylpropy…
| 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) | 2.72 | 6.58 | -98.42 | 4 | 3 | 2 | 35 | 269.477 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.72 | 4.45 | -38.85 | 3 | 3 | 1 | 34 | 268.469 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
