In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2008 | 27 | Yes |
Popular Name: 2-[2-[(1,3-benzodioxol-5-ylmethylamino)methyl]phenoxy]-N-tert-butyl-acetamide 2-[2-[(1,3-benzodioxol-5-ylmethy…
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) | 3.09 | 7.78 | -47.03 | 3 | 6 | 1 | 73 | 371.457 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.09 | 6.37 | -14.8 | 2 | 6 | 0 | 69 | 370.449 | 8 | ↓ |