| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 11th, 2010 | 18 | Yes |
Popular Name: (5-amino-1H-pyrazol-4-yl)-[4-[(1S)-1-methylpropyl]piperazin-1-yl]methanone (5-amino-1H-pyrazol-4-yl)-[4-[(1…
| 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) | -0.08 | 1.56 | -7.65 | 3 | 6 | 0 | 78 | 251.334 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.08 | 3.43 | -45.39 | 4 | 6 | 1 | 79 | 252.342 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
