| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 24th, 2010 | 17 | Yes |
Popular Name: (2S,4R)-1-[(4-ethylcyclohexyl)methyl]-2-methyl-piperidin-4-amine (2S,4R)-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) | 2.68 | 5.63 | -40.55 | 3 | 2 | 1 | 31 | 239.427 | 3 | ↓ |
| Mid Mid (pH 6-8) | 2.68 | 7.25 | -32.06 | 3 | 2 | 1 | 30 | 239.427 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.68 | 7.57 | -111.46 | 4 | 2 | 2 | 32 | 240.435 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
