In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2010 | 20 | Yes |
Popular Name: [4-[(1S,2R)-2-amino-1-(2-pyridyl)butoxy]phenyl]methanol [4-[(1S,2R)-2-amino-1-(2-pyridyl…
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) | 1.49 | 2.66 | -36.95 | 4 | 4 | 1 | 70 | 273.356 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.49 | 2.39 | -6.14 | 3 | 4 | 0 | 68 | 272.348 | 6 | ↓ |