| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 18 | Yes |
Popular Name: (4S)-N-[(1R)-1-(3-methyl-2-thienyl)ethyl]-4,5,6,7-tetrahydrobenzofuran-4-amine (4S)-N-[(1R)-1-(3-methyl-2-thien…
| 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) | 2.78 | 7.52 | -34.98 | 2 | 2 | 1 | 30 | 262.398 | 3 | ↓ |
| Hi High (pH 8-9.5) | 2.78 | 6.91 | -5.24 | 1 | 2 | 0 | 25 | 261.39 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
