| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 17th, 2011 | 20 | Yes |
Popular Name: [6-[(2S)-2-(aminomethyl)-5-methyl-2,3-dihydrobenzofuran-7-yl]-3-pyridyl]methanamine [6-[(2S)-2-(aminomethyl)-5-methy…
| 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) | 0.97 | 3.31 | -104.66 | 6 | 4 | 2 | 77 | 271.364 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 2.48 | -10.11 | 4 | 4 | 0 | 74 | 269.348 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.97 | 2.9 | -45.69 | 5 | 4 | 1 | 76 | 270.356 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
