| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 23rd, 2009 | 18 | Yes |
Popular Name: 4-[(1S)-2-(2-dimethylaminoethylamino)-1-hydroxy-ethyl]-2-methoxy-phenol 4-[(1S)-2-(2-dimethylaminoethyla…
| 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) | -0.07 | 1.33 | -122.29 | 5 | 5 | 2 | 71 | 256.346 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.07 | 1.78 | -82.51 | 4 | 5 | 1 | 74 | 255.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.07 | -1.07 | -45.04 | 4 | 5 | 1 | 70 | 255.338 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.07 | -2.55 | -8.32 | 3 | 5 | 0 | 65 | 254.33 | 7 | ↓ |
