| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 26th, 2010 | 18 | Yes |
Popular Name: 4-[4-(2-pyrazol-1-ylethyl)piperazin-1-yl]butan-1-amine 4-[4-(2-pyrazol-1-ylethyl)pipera…
| 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) | -0.35 | 3.44 | -101.65 | 4 | 5 | 2 | 53 | 253.394 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.35 | 1.17 | -46.12 | 3 | 5 | 1 | 52 | 252.386 | 7 | ↓ |
| Mid Mid (pH 6-8) | -0.35 | 3.45 | -91.9 | 4 | 5 | 2 | 53 | 253.394 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
