| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 28th, 2011 | 15 | Yes |
Popular Name: (3R)-N-[(1S,2R,4S)-2,4-dimethylcyclohexyl]piperidin-3-amine (3R)-N-[(1S,2R,4S)-2,4-dimethylc…
| 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) | 2.08 | 4.67 | -37.83 | 3 | 2 | 1 | 29 | 211.373 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 4.33 | -33.96 | 3 | 2 | 1 | 29 | 211.373 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 2.08 | 5.68 | -111.77 | 4 | 2 | 2 | 33 | 212.381 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
