| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 21st, 2009 | 20 | Yes |
Popular Name: N-[(5-bromo-2-thienyl)methyl]-1-(3,4-dihydro-2H-1,5-benzodioxepin-9-yl)methanamine N-[(5-bromo-2-thienyl)methyl]-1-…
| 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) | 3.68 | 8.11 | -48.49 | 2 | 3 | 1 | 35 | 355.277 | 4 | ↓ |
| Hi High (pH 8-9.5) | 3.68 | 6.75 | -6.12 | 1 | 3 | 0 | 30 | 354.269 | 4 | ↓ |
