| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 18th, 2011 | 19 | Yes |
Popular Name: [(2S)-7-[3-(aminomethyl)phenyl]-2,3-dihydrobenzofuran-2-yl]methanamine [(2S)-7-[3-(aminomethyl)phenyl]-…
| 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) | 1.69 | 4.23 | -99.64 | 6 | 3 | 2 | 65 | 256.349 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 3.83 | -46.02 | 5 | 3 | 1 | 63 | 255.341 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.69 | 3.81 | -47.25 | 5 | 3 | 1 | 63 | 255.341 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
