| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 18 | Yes |
Popular Name: 1-(1,3-benzodioxol-4-yl)-N-[(5-bromo-2-thienyl)methyl]methanamine 1-(1,3-benzodioxol-4-yl)-N-[(5-b…
| 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) | 3.59 | 6.75 | -47.79 | 2 | 3 | 1 | 35 | 327.223 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.59 | 5.4 | -6.24 | 1 | 3 | 0 | 30 | 326.215 | 4 | ↓ |
