In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 10th, 2010 | 19 | Yes |
Popular Name: (2R)-2-(1,3-benzodioxol-5-yloxy)-2-(5-chloro-2-thienyl)ethanamine (2R)-2-(1,3-benzodioxol-5-yloxy)…
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) | 2.97 | 4.4 | -49.4 | 3 | 4 | 1 | 55 | 298.771 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.97 | 4.1 | -6.18 | 2 | 4 | 0 | 54 | 297.763 | 4 | ↓ |