| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 29th, 2009 | 20 | Yes |
Popular Name: 4-[(isopropylamino)methyl]-N,N,5-trimethyl-2-phenyl-pyrazol-3-amine 4-[(isopropylamino)methyl]-N,N,5…
| 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) | 2.27 | 9.09 | -38.3 | 2 | 4 | 1 | 38 | 273.404 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.27 | 7.87 | -6.52 | 1 | 4 | 0 | 33 | 272.396 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.27 | 9.19 | -90.77 | 3 | 4 | 2 | 39 | 274.412 | 5 | ↓ |
