| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 23rd, 2009 | 20 | Yes |
Popular Name: 1-[4-[(1-tert-butylpyrazol-4-yl)methylamino]-1-piperidyl]ethanone 1-[4-[(1-tert-butylpyrazol-4-yl)…
| 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) | 0.84 | 6.31 | -53.04 | 2 | 5 | 1 | 55 | 279.408 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.84 | 5.05 | -11.57 | 1 | 5 | 0 | 50 | 278.4 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
