| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | Yes |
Popular Name: (3S)-1-[2-(cyclohexylamino)-2-oxo-ethyl]-3-methyl-piperidine-3-carboxylic (3S)-1-[2-(cyclohexylamino)-2-ox…
| 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) | 2.12 | 7.6 | -47.47 | 2 | 5 | 0 | 74 | 282.384 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.12 | 5.8 | -48.33 | 1 | 5 | -1 | 72 | 281.376 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
