| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 16th, 2011 | 18 | Yes |
Popular Name: 4-ethyl-N-methyl-N-[[(3S)-3-methyl-3-piperidyl]methyl]cyclohexanamine 4-ethyl-N-methyl-N-[[(3S)-3-meth…
| 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) | 3.16 | 8.85 | -97.16 | 3 | 2 | 2 | 21 | 254.462 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 6.85 | -36.52 | 2 | 2 | 1 | 20 | 253.454 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 7.52 | -33.41 | 2 | 2 | 1 | 16 | 253.454 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
