| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 18 | Yes |
Popular Name: 4-[(1S)-1-(2-pyrrolidin-1-ylethylamino)ethyl]benzene-1,3-diol 4-[(1S)-1-(2-pyrrolidin-1-ylethy…
| 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) | 1.93 | 0.25 | -42.94 | 4 | 4 | 1 | 60 | 251.35 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.93 | 1.04 | -46.7 | 3 | 4 | 0 | 63 | 250.342 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.93 | 1.5 | -39.66 | 4 | 4 | 1 | 57 | 251.35 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 2.77 | -119.3 | 5 | 4 | 2 | 61 | 252.358 | 5 | ↓ |
