| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 20th, 2011 | 21 | Yes |
Popular Name: (2S)-1-[4-(aminomethyl)phenoxy]-3-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]propan-2-ol (2S)-1-[4-(aminomethyl)phenoxy]-…
| 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) | 0.71 | 2.01 | -91.76 | 5 | 5 | 2 | 65 | 295.427 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 4.41 | -170.5 | 6 | 5 | 3 | 66 | 296.435 | 7 | ↓ |
| Mid Mid (pH 6-8) | 0.71 | 1.98 | -90.15 | 5 | 5 | 2 | 65 | 295.427 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
