| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2010 | 17 | Yes |
Popular Name: N-[2-[(3S,5S)-3,5-dimethyl-1-piperidyl]ethyl]cyclohexanamine N-[2-[(3S,5S)-3,5-dimethyl-1-pip…
| 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) | 3.66 | 8.98 | -115.21 | 3 | 2 | 2 | 21 | 240.435 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.66 | 7.81 | -31.22 | 2 | 2 | 1 | 16 | 239.427 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.66 | 7.12 | -36.92 | 2 | 2 | 1 | 20 | 239.427 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
