| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 10th, 2011 | 17 | Yes |
Popular Name: 4-[[cyclobutylmethyl(methyl)amino]methyl]-N,2,5-trimethyl-pyrazol-3-amine 4-[[cyclobutylmethyl(methyl)amin…
| 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) | 1.36 | 6.68 | -90.99 | 3 | 4 | 2 | 36 | 238.379 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 6.55 | -37.88 | 2 | 4 | 1 | 34 | 237.371 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.36 | 4.23 | -6.08 | 1 | 4 | 0 | 33 | 236.363 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.36 | 4.36 | -24.92 | 2 | 4 | 1 | 34 | 237.371 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
