| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 17 | Yes |
Popular Name: 4-[(1S)-1-[(2-dimethylamino-2-methyl-propyl)amino]ethyl]phenol 4-[(1S)-1-[(2-dimethylamino-2-me…
| 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) | 2.42 | 3.57 | -38.03 | 3 | 3 | 1 | 40 | 237.367 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.42 | 4.35 | -58.93 | 2 | 3 | 0 | 43 | 236.359 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.42 | 4.46 | -33.86 | 3 | 3 | 1 | 37 | 237.367 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 2.42 | 5.68 | -117.25 | 4 | 3 | 2 | 41 | 238.375 | 5 | ↓ |
