| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 24th, 2009 | 21 | Yes |
Popular Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-thienylmethylamino)propan-1-ol (2S)-2-(2,3-dihydro-1,4-benzodio…
| 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) | 2.30 | 4.4 | -40.17 | 3 | 4 | 1 | 55 | 306.407 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.30 | 3.29 | -7.73 | 2 | 4 | 0 | 51 | 305.399 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
