| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 17th, 2011 | 20 | Yes |
Popular Name: (3R)-1-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methyl]-3-ethyl-piperidine-3-carboxylic (3R)-1-[(5-chloro-1,3-dimethyl-p…
| 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) | 1.74 | 8.15 | -44.72 | 1 | 5 | 0 | 62 | 299.802 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.74 | 6.31 | -46.12 | 0 | 5 | -1 | 61 | 298.794 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
