| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 22nd, 2009 | 18 | Yes |
Popular Name: (4S)-N-[(1S)-1-(3-bromo-2-thienyl)ethyl]-4,5,6,7-tetrahydrobenzofuran-4-amine (4S)-N-[(1S)-1-(3-bromo-2-thieny…
| 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) | 3.14 | 8.12 | -34.43 | 2 | 2 | 1 | 30 | 327.267 | 3 | ↓ |
| Hi High (pH 8-9.5) | 3.14 | 7.07 | -3.92 | 1 | 2 | 0 | 25 | 326.259 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
