| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 17th, 2010 | 18 | Yes |
Popular Name: (2S)-1-(3,5-dimethylphenyl)-3-(4-pyridyl)propan-2-amine (2S)-1-(3,5-dimethylphenyl)-3-(4…
| 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) | 2.32 | 7.38 | -48.02 | 3 | 2 | 1 | 41 | 241.358 | 4 | ↓ |
| Hi High (pH 8-9.5) | 2.32 | 7.08 | -5.63 | 2 | 2 | 0 | 39 | 240.35 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.32 | 7.84 | -104.83 | 4 | 2 | 2 | 42 | 242.366 | 4 | ↓ |
