| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 24th, 2009 | 19 | Yes |
Popular Name: (S)-(2,5-dibromo-3-thienyl)-(2,3-dihydro-1,4-benzodioxin-6-yl)methanamine (S)-(2,5-dibromo-3-thienyl)-(2,3…
| 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) | 3.86 | 5.7 | -50.23 | 3 | 3 | 1 | 46 | 406.119 | 2 | ↓ |
| Hi High (pH 8-9.5) | 3.86 | 5.38 | -5.48 | 2 | 3 | 0 | 44 | 405.111 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
