| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 3rd, 2011 | 20 | Yes |
Popular Name: (1S)-N-[(1S)-1-(benzofuran-2-yl)ethyl]-1-(3-methyl-2-thienyl)ethanamine (1S)-N-[(1S)-1-(benzofuran-2-yl)…
| 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) | 4.85 | 9.45 | -36.61 | 2 | 2 | 1 | 30 | 286.42 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.85 | 8.42 | -6.89 | 1 | 2 | 0 | 25 | 285.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
