| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 4th, 2010 | 18 | Yes |
Popular Name: (1S)-1-(5-bromo-2-thienyl)-1-[(2S)-2,3-dihydrobenzofuran-2-yl]-N-methyl-methanamine (1S)-1-(5-bromo-2-thienyl)-1-[(2…
| 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) | 4.17 | 7.68 | -43.91 | 2 | 2 | 1 | 26 | 325.251 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.17 | 6.46 | -5.41 | 1 | 2 | 0 | 21 | 324.243 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
