| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 17 | Yes |
Popular Name: (3R,4S)-1-[(4-ethylcyclohexyl)methyl]-3-methyl-piperidin-4-amine (3R,4S)-1-[(4-ethylcyclohexyl)me…
| 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) | 2.83 | 7.71 | -30.27 | 3 | 2 | 1 | 30 | 239.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 6.04 | -39.29 | 3 | 2 | 1 | 31 | 239.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.83 | 7.97 | -111.06 | 4 | 2 | 2 | 32 | 240.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
