| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2008 | 19 | Yes |
Popular Name: 4-[(1S)-1-[(1,3,5-trimethylpyrazol-4-yl)amino]ethyl]benzene-1,3-diol 4-[(1S)-1-[(1,3,5-trimethylpyraz…
| 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) | 2.01 | 0.84 | -13.99 | 3 | 5 | 0 | 70 | 261.325 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.01 | 1.62 | -48.16 | 2 | 5 | -1 | 73 | 260.317 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.01 | 0.93 | -34.38 | 4 | 5 | 1 | 72 | 262.333 | 3 | ↓ |
