| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2009 | 19 | Yes |
Popular Name: 2-[4-(hydroxymethyl)-3,5-dimethyl-pyrazol-1-yl]-1-(4-methylpiperazin-1-yl)ethanone 2-[4-(hydroxymethyl)-3,5-dimethy…
| 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) | -0.66 | 0.51 | -17.21 | 1 | 6 | 0 | 62 | 266.345 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.66 | 2.86 | -55.89 | 2 | 6 | 1 | 63 | 267.353 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
