| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 16th, 2008 | 21 | Yes |
Popular Name: 3-[(1S)-1-[[(2R)-2-dimethylamino-2-phenyl-ethyl]amino]ethyl]phenol 3-[(1S)-1-[[(2R)-2-dimethylamino…
| 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) | 3.16 | 7.12 | -39.82 | 3 | 3 | 1 | 37 | 285.411 | 6 | ↓ |
| Hi High (pH 8-9.5) | 3.16 | 4.88 | -5.97 | 2 | 3 | 0 | 35 | 284.403 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 3.16 | 8.23 | -128.63 | 4 | 3 | 2 | 41 | 286.419 | 6 | ↓ |
